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Product name

CAS

Formula

4-Nitropyrene

CAS57835-92-4

FormulaC16H9NO2

Synonym4-NITROPYRENE, 4-nitro-pyren, 4-05-00-02471 (Beilstein Handbook Reference), 4-Nitropyrene, BRN 1979733, CCRIS 4231, HSDB 7769, UNII-XOT1408EDI, 4-Nitropyrene, Pyrene, 4-nitro-, Superlist Names 4-Nitropyrene, 4-Nitropyrene [Nitroarenes]

Molecular weight247.25

SMILESc12c3c4cc(c1cccc2ccc3ccc4)[N+](=O)[O-]

1,4-Bis(methylisocyanate)cyclohexane

CAS10347-54-3

FormulaC10H14N2O2

Synonym1,4-bis(isocyanatomethyl)cyclohexane, CYCLOHEXANE,1,4-BIS(ISOCYANATOMETHYL)-, [(1,4-Cyclohexanediyl)bismethylene]diisocyanate, [(Cyclohexane-1,4-diyl)bismethylene]bisisocyanate, 1,4-Cyclohexanebis(methylene isocyanate), 1,4-bis(isocyanatomethyl)cyclohexane

Molecular weight194.23

EINECS233-757-2

1,4-Cyclohexane diisocyanate

CAS2556-36-7

FormulaC8H10N2O2

Synonymcyclohex-1,4-ylene diisocyanate, 1,4-diisocyanatocyclohexane, cyclohexane diisocyanate, CYCLOHEXANE,1,4-DIISOCYANATO-, 1,4-cyclohexylene diisocyanate, (1,4-Cyclohexanediyl)bisisocyanate, (1,4-Cyclohexanediyl)diisocyanate, Cyclohexane-1,4-diylbisisocyanate, cyclohex-1,4-ylene diisocyanate

Molecular weight166.18

EINECS219-869-4

4,4'-Diisocyanatodiphenyl ether

CAS4128-73-8

FormulaC14H8N2O3

SynonymOXYBIS(4-PHENYL ISOCYANATE), 1,1’-oxybis[4-isocyanato-benzen, 4,4'-OXYBIS(PHENYL ISOCYANATE), 4,4'-Diisocyanato[1,1'-oxybisbenzene], 4,4'-Oxybis(isocyanatobenzene), Oxybis(1,4-phenylene)bisisocyanate, Oxybis(1,4-phenylene)diisocyanate, Oxybis(4-phenyl isocyanate),99%, 4,4'-OXYBIS(PHENYL ISOCYANATE)

Molecular weight252.22

SMILESc1(Oc2ccc(N=C=O)cc2)ccc(N=C=O)cc1

2,4'-Diisocyanatodiphenyl sulfide

CAS75790-87-3

FormulaC14H8N2O2S

Synonymo-[(p-isocyanatophenyl)thio]phenyl isocyanate, 1-Isocyanato-2-[(4-isocyanatophenyl)thio]benzene, o-[(p-isocyanatophenyl)thio]phenyl isocyanate

Molecular weight268.29

EINECS278-313-9

3,3'-Dimethyldiphenylmethane-4,4'-diisocyanate

CAS139-25-3

FormulaC17H14N2O2

Synonym1,1’-methylenebis[4-isocyanato-3-methyl-benzen, 5,5’-methylenebis(2-isocyanato-toluen, 5,5’-methylenebis(2-isocyanatotoluene), benzene,1,11-methylenebis(4-isocyanato-3-methyl-, diisocyanatodimethyldiphenylmethane, isocyanicacid,esterwithdi-o-toluenemethane, 3,3'-DIMETHYLDIPHENYLMETHANE-4,4'-DIISOCYANATE, 4,4'-DIISOCYANATO-3,3'-DIMETHYLDIPHENYLMETHANE, 4,4'-DIISOCYANATO-3,3'-DIMETHYLDIPHENYLMETHANE

Molecular weight278.31

4-Methyldiphenylmethane-3,4-diisocyanate

CAS75790-84-0

FormulaC16H12N2O2

Synonym5-(p-isocyanatobenzyl)-o-tolyl isocyanate, BENZENE,2-ISOCYANATO-4-((4-ISOCYANATOPHENYL)METHYL)-1-MET., 2-Isocyanato-4-[(4-isocyanatophenyl)methyl]-1-methylbenzene, 5-(p-isocyanatobenzyl)-o-tolyl isocyanate

Molecular weight264.28

EINECS278-312-3

SMILESc1(Cc2ccc(N=C=O)cc2)cc(c(C)cc1)N=C=O

1,2,3,7,8-Pentachlorodibenzo-p-dioxin

CAS40321-76-4

FormulaC12H3Cl5O2

Synonym1,2,3,7,8-pentachloro-dibenzo-p-dioxi, 1,2,3,7,8-Pentachlorooxanthrene, Dibenzo-p-dioxin, 1,2,3,7,8-pentachloro-, 1,2,3,7,8-PENTACHLORODIBENZODIOXIN, 1,2,3,7,8-PECDD, 1,2,3,7,8-PENTACHLORODIBENZO-PARA-DIOXIN, 1,2,3,7,8-PCDD, 1,2,3,7,8-PNCDD, 1,2,3,7,8-PENTACHLORODIBENZO-P-DIOXIN

Molecular weight356.42

1,2,3,4,7,8-Hexachlorodibenzo-p-dioxin

CAS39227-28-6

FormulaC12H2Cl6O2

Synonym1,2,3,4,7,8-hexachlorodibenzo(b,e)(1,4)dioxin, 1,2,3,4,7,8-hexachlorodibenzodioxin, 1,2,3,4,7,8-hexachloro-dibenzo-p-dioxi, 1,2,3,4,7,8-Hexachlorooxanthrene, d66, Dibenzo-p-dioxin, hexachloro-, Hcdd, Hexachlorodibenzo-p-dioxin

Molecular weight390.86

1,2,3,6,7,8-Hexachlorodibenzo-p-dioxin

CAS57653-85-7

FormulaC12H2Cl6O2

Synonyme)(1,4)dioxin,1,2,3,6,7,8-hexachloro-dibenzo(, nci-c03703, 1,2,3,6,7,8-HCDD, Hexachlorodibenzo-p-dioxin, 1,2,3,6,7,8-, 1,2,3,6,7,8-Hexachlorodibenzo[b,e][1,4]dioxin, D-67, HxCDD, PCDD-67, 1,2,3,6,7,8-Hexa polychlorinated dibenzo-p-dioxin, 1,2,3,6,7,8-Hexachlorodibenzo-p-dioxin, 1,2,3,6,7,8-Hexachlorodibenzo-para-dioxin, 1,2,3,6,7,8-Hexachlorodibenzodioxin, 1,2,3,6,7,8-HXCDD, 5-19-02-00042 (Beilstein Handbook Reference), BRN 1627652, CCRIS 323, Dibenzo(b,e)(1,4)dioxin, 1,2,3,6,7,8-hexachloro-, Hcdd mixture, HSDB 4154, NCI-C03703, UNII-B94L7A4G3D, 1,2,3,6,7,8-Hcdd/1,2,3,7,8,9-hcdd, Dibenzo(b,e)(1,4)dioxin, 1,2,3,6,7,8-hexachloro-, Dibenzo-p-dioxin, 1,2,3,6,7,8-hexachloro-, Superlist Names 1,2,3,6,7,8-Hexachlorodibenzo(b,e)(1,4)dioxin, 1,2,3,6,7,8-Hexachlorodibenzo-p-dioxin, 1,2,3,6,7,8-Hexachlorodibenzo-p-dioxin [Dioxin and dioxin-like compounds]

Molecular weight390.86

SMILESc1c2c(c(c(c1Cl)Cl)Cl)Oc3cc(c(c(c3O2)Cl)Cl)Cl

Melting Point285 ° C

Henry's Law Constant1.94E-06 atm-m3/mole

Water solubility2.65E-05 mg/L

log P (octanol-water)8.210

Atmospheric OH Rate Constant3.14E-13 cm3/molecule-sec

1,2,3,7,8,9-Hexachlorodibenzo-p-dioxin

CAS19408-74-3

FormulaC12H2Cl6O2

Synonym1,2,3,7,8,9-hexachlorodibenzo(b,e)(1,4)dioxin, 1,2,3,7,8,9-hexachloro-dibenzo-p-dioxi, d70, Dibenzo-p-dioxin, 1,2,3,7,8,9-hexachloro-, DIBENZO-PARA-DIOXIN,HEXACHLORO-, 1,2,3,7,8,9-HCDD, 1,2,3,7,8,9-HXCDD, 2,3,4,6,7,8-HCDD, 1,2,3,7,8,9-HEXACHLORODIBENZO-P-DIOXIN

Molecular weight390.86

1,2,3,4,6,7,8-Heptachlorodibenzo-p-dioxin

CAS35822-46-9

FormulaC12HCl7O2

Synonym1,2,3,4,6,7,8-heptachlorodibenzodioxin, 1,2,3,4,6,7,8-heptachlorodibenzo-para-dioxin, 1,2,3,4,6,7,8-heptachloro-dibenzo-p-dioxi, e)(1,4)dioxin,1,2,3,4,6,7,8-heptachloro-dibenzo(, heptachlorodibenzo-p-dioxin, Dibenzo-p-dioxin, 1,2,3,4,6,7,8-heptachloro., HEPTACHLORODIBENZODIOXIN, 1,2,3,4,6,7,8-HPCDD

Molecular weight425.31

1,2,3,4,6,7,8,9-Octachlorodibenzo-p-dioxin

CAS3268-87-9

FormulaC12Cl8O2

Synonym1,2,3,4,6,7,8,9-octachlorodibenzo(b,e)(1,4)dioxin, 1,2,3,4,6,7,8,9-Octachlorodibenzo[1,4]dioxin, 1,2,3,4,6,7,8,9-Octachlorodibenzodioxin, 1,2,3,4,6,7,8,9-octachloro-dibenzo-p-dioxi, 1,2,3,4,6,7,8,9-Octachlorooxanthrene, 1,2,3,4,6,7,8,9-Octachorodibenzo-p-dioxin, Dibenzo[b,e][1,4]dioxin, octachloro-, Dibenzo-p-dioxin, 1,2,3,4,6,7,8,9-octachloro-, 1,2,3,4,6,7,8,9-OCTACHLORODIBENZO-P-DIOXIN, 1,2,3,4,6,7,8,9-Octachlorodibenzo(1,4)dioxin, 1,2,3,4,6,7,8,9-Octachlorodibenzo(b,e)(1,4)dioxin, 1,2,3,4,6,7,8,9-Octachlorodibenzo-p-dioxin, 1,2,3,4,6,7,8,9-Octachlorodibenzodioxin, 1,2,3,4,6,7,8,9-Octachorodibenzo-p-dioxin, 5-19-02-00042 (Beilstein Handbook Reference), BRN 0356027, CCRIS 4687, Dibenzo-p-dioxin, 1,2,3,4,6,7,8,9-octachloro-, HSDB 6480, NCI-C03678, NSC 37651, OCDD, Octa polychlorinated dibenzo-p-dioxin, Octachloro-para-dibenzodioxin, Octachlorodibenzo(b,e)(1,4)dioxin, Octachlorodibenzo-p-dioxin, Octachlorodibenzodioxin, UNII-YW59P10266, Dibenzo(b,e)(1,4)dioxin, octachloro-, Dibenzo(b,e)(1,4)dioxin, octachloro- (9CI), Dibenzo-p-dioxin, 1,2,3,4,6,7,8,9-octachloro-, Dibenzo-p-dioxin, octachloro- (8CI), Octachlorodibenzodioxin, Superlist Names 1,2,3,4,6,7,8,9-dibenzo-p-dioxin, 1,2,3,4,6,7,8,9-dibenzo-p-dioxin [Dioxin and dioxin-like compounds], Octachlorodibenzo(b,e)(1,4)dioxin

Molecular weight459.75

SMILESc12c(c(c(Cl)c(c1Cl)Cl)Cl)Oc1c(c(Cl)c(c(c1O2)Cl)Cl)Cl

Vapor Pressure8.25E-13 mm Hg

Henry's Law Constant6.74E-06 atm-m3/mole

Boiling Point510 ° C

log P (octanol-water)8.2

Melting Point330 ° C

Water solubility4.00E-07 mg/L

Atmospheric OH Rate Constant1.60E-12 cm3/molecule-sec

2,3,7,8-Tetrachlorodibenzofuran

CAS51207-31-9

FormulaC12H4Cl4O

Synonym2,3,7,8-Tetrachlorodibenzo[b,d]furan, 2,3,7,8-tetrachloro-dibenzofura, 2,3,7,8-tetrachlorodibenzofuran(tcdf)6a, Dibenzofuran, 2,3,7,8-tetrachloro-, NCI-C56611, tcdbf, tcdf, 2378TETRACHLORODIBENZO-PARA-FURAN

Molecular weight305.97

1,2,3,7,8- Pentachlorodibenzofuran

CAS57117-41-6

FormulaC12H3Cl5O

Synonym1,2,3,7,8-pentaCDF, 1,2,3,7,8-Pentachlorodibenzo[b,d]furan, 1,2,3,7,8-pentachloro-dibenzofura, Dibenzofuran, 1,2,3,7,8-pentachloro-, 1,2,3,7,8-PCDF, 1,2,3,7,8-PECDF, 12378PENTACHLORODIBENZO-PARA-FURAN, 1,2,3,7,8-PNCDF, 1,2,3,7,8-PENTACHLORODIBENZOFURAN

Molecular weight340.42

2,3,4,7,8-Pentachlorodibenzofuran

CAS57117-31-4

FormulaC12H3Cl5O

Synonym2,3,4,7,8-pentachloro-dibenzofura, Dibenzofuran, 2,3,4,7,8-pentachloro-, 2,3,4,7,8-PECDF, 2,3,4,7,8-PENTACHLORODIPHENYLENEOXIDE, 2,3,4,7,8-PNCDF, 2,3,4,7,8-PENTACDF, 2,3,4,7,8-PCDF, 23478PENTACHLORODIBENZO-PARA-FURAN, 2,3,4,7,8-PENTACHLORODIBENZOFURAN, 2,3,4,7,8-Pentachlorodibenzofuran, 2,3,4,7,8-Pentapolychlorinated dibenzofuran, 4-PeCDF, CCRIS 3492, HSDB 7178, UNII-U4C2RV3124, 2,3,4,7,8-Pentachlorodibenzofuran, Dibenzofuran, 2,3,4,7,8-pentachloro-, Superlist Names 2,3,4,7,8-Pentachlorodibenzofuran, 2,3,4,7,8-Pentachlorodibenzofuran [Dioxin and dioxin-like compounds]

Molecular weight340.42

SMILESc1c2c3cc(c(c(c3oc2cc(c1Cl)Cl)Cl)Cl)Cl

Vapor Pressure3.46E-07 mm Hg

Water solubility2.35E-04 mg/L

Henry's Law Constant1.14E-05 atm-m3/mole

Atmospheric OH Rate Constant1.15E-13 cm3/molecule-sec

log P (octanol-water)6.92

1,2,3,4,7,8-Hexachlorod-benzofuran

CAS70648-26-9

FormulaC12H2Cl6O

Synonym1,2,3,4,7,8-HEXACDF, 123478HEXACHLORODIBENZO-PARA-FURAN, 1,2,3,4,7,8-HCDF, 1,2,3,4,7,8-HXCDF, 1,2,3,4,7,8-HEXACHLORODIPHENYLENEOXIDE, Hexachlorodibenzofuran, 1,2,3,4,7,8-, 1,2,3,4,7,8-hexachlorodibenzo[b,d]furan, 1,2,3,4,7,8-hexachlorodibenzofuran

1,2,3,6,7,8-Hexachlorodibenzofuran

CAS57117-44-9

FormulaC12H2Cl6O

Synonym1,2,3,6,7,8-HEXACHLORODIPHENYLENEOXIDE, 1,2,3,6,7,8-HXCDF, 1,2,3,6,7,8-HCDF, Hexachlorodibenzofuran, 1,2,3,6,7,8-, 2,3,4,7,8,9-Hexachlorodibenzofuran, 2,3,4,7,8,9-HxCDF, 1,2,3,6,7,8-HEXACHLORODIPHENYLENEOXIDE

1,2,3,7,8,9-Hexachlorodibenzofuran

CAS72918-21-9

FormulaC12H2Cl6O

Synonym1,2,3,7,8,9-HCDF, 1,2,3,7,8,9-HEXACHLORODIPHENYLENEOXIDE, 1,2,3,7,8,9-HXCDF, Hexachlorodibenzofuran, 1,2,3,7,8,9-: (HexaCDF, 1,2,3,7,8,9-), PCDF 122, 1,2,3,7,8,9-HCDF

Molecular weight374.87

2,3,4,6,7,8-Hexachlorodibenzofuran

CAS60851-34-5

FormulaC12H2Cl6O

Synonym2,3,4,6,7,8-HXCDF, 2,3,4,6,7,8-HCDF, 2,3,4,6,7,8-HEXACHLORODIPHENYLENEOXIDE, Hexachlorodibenzofuran, 2,3,4,6,7,8-, 2,3,4,6,7,8-HXCDF UNLABELED (10 UG/ML IN MEOH), 2,3,4,6,7,8-H6CDF, 2,3,4,6,7,8-HXCDF, 2,3,4,6,7,8-Hexachlorodibenzofuran, F 130, UNII-IMR03169ES, Systematic Name Dibenzofuran, 2,3,4,6,7,8-hexachloro-, Superlist Names 2,3,4,6,7,8-Hexachlorodibenzofuran, 2,3,4,6,7,8-Hexachlorodibenzofuran [Dioxin and dioxin-like compounds]

SMILESc1c2c3cc(c(c(c3oc2c(c(c1Cl)Cl)Cl)Cl)Cl)Cl

1,2,3,4,6,7,8-Heptachlorodibenzofuran

CAS67562-39-4

FormulaC12HCl7O

Synonym1,2,3,4,6,7,8-HCDF, 1,2,3,4,6,7,8-HPCDF, 1,2,3,4,6,7,8-HEPTACHLORODIPHENYLENEOXIDE, Heptachlorodibenzofuran, 1,2,3,4,6,7,8-: (HeptaCDF, 1,2,3,4,6,7,8-), F 131, HpCDF, PCDF 131, 1,2,3,4,6,7,8-H7CDF, 1,2,3,4,6,7,8-HCDF

Molecular weight409.31

1,2,3,4,7,8,9-Heptachlorodibenzofuran

CAS55673-89-7

FormulaC12HCl7O

Synonym1,2,3,6,7,8,9-HEPTACHLORODIBENZOFURAN, 1,2,3,4,7,8,9-HPCDF, 1,2,3,4,7,8,9-HEPTACHLORODIPHENYLENEOXIDE, 1,2,3,4,7,8,9-HCDF, Heptachlorodibenzofuran, 1,2,3,4,7,8,9- : (HeptaCDF, 1,2,3,4,7,8,9-), 1,2,3,4,7,8,9-CDF, F 134, PCDF 134, 1,2,3,6,7,8,9-HEPTACHLORODIBENZOFURAN

1,2,3,4,6,7,8,9-Octachlorodibenzofuran

CAS39001-02-0

FormulaC12Cl8O

Synonym1,2,3,4,6,7,8,9-Octachlorodibenzo[b,d]furan, Dibenzofuran, octachloro-, f135, octachloro-dibenzofura, Perchlorodibenzofuran, 1,2,3,4,6,7,8,9-OCDF, 1,2,3,4,6,7,8,9-OCTACHLORODIPHENYLENEOXIDE, OCDF, 1,2,3,4,6,7,8,9-OCTACHLORODIBENZOFURAN, 1,2,3,4,6,7,8,9-Octachlorodibenzofuran, F 135, Octachlorodibenzofuran, Octapolychlorinated dibenzofuran, Perchlorodibenzofuran, UNII-9C00M3WUEE, Systematic Name Dibenzofuran, octachloro-, Superlist Names 1,2,3,4,6,7,8,9-Octachlorodibenzofuran, 1,2,3,4,6,7,8,9-Octachlorodibenzofuran [Dioxin and dioxin-like compounds], Octachlorodibenzofuran

Molecular weight443.75

SMILESc12c3c(c(c(Cl)c(c3Cl)Cl)Cl)oc1c(c(Cl)c(c2Cl)Cl)Cl

Atmospheric OH Rate Constant1.07E-14 cm3/molecule-sec

Melting Point258 ° C

Water solubility1.16E-06 mg/L

log P (octanol-water)8.6

Henry's Law Constant1.89E-06 atm-m3/mole

Vapor Pressure3.75E-12 mm Hg

Isononylphenol

CAS11066-49-2

FormulaC15H24O

Synonymisononylphenol, Phenol, isononyl-, isononyl-pheno, Einecs 234-284-4

Molecular weight220.35

EINECS234-284-4

4-Isononylphenol

CAS26543-97-5

FormulaC15H24O

Synonymp-isononylphenol, 4-(7-Methyloctyl)phenol, 4-Isononylphenol, Phenol, 4-isononyl-, p-isononylphenol

EINECS247-770-6

Molecular weight220.35

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