SynonymMOPP
Toxic Release Inventory (TRI) Chemicals
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Formula
CAS77439-76-0
FormulaC5H3Cl3O3
Synonym3-Chloro-4-(dichloromethyl)-5-hydroxy-2,5-dihydrofuran-2-one, 3-Chloro-4-(dichloromethyl)-5-hydroxyfuran 2(5H)-one, 3-Chloro-4-(dichloromethyl)-5, Mutagen X, 3-chloro-4-dichloromethyl-5-hydroxy-2(5h)-furanon, chloro(dichloromethyl)-5-hydroxy-2(5h)-furanone, 3-CHLORO-4-(DICHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE, MX, 3-CHLORO-4-(DICHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE
Molecular weight217.43
CAS505-60-2
FormulaC4H8Cl2S
SynonymDichlorodiethyl sulfide, Mustard gas, 2,2`-dichlorodiethyl sulfide, bis-ß-chloroethyl sulfide, ß,ß'-dichloroethyl sulfide, BIS(BETA-CHLOROETHYL)SULPHIDE, YPERITE, BIS(2-CHLOROETHYL)SULPHIDE
Molecular weight159.08
CAS3771-19-5
FormulaC20H22O3
SynonymNafenopin, 2-METHYL-2-PARA-(1,2,3,4-TETRAHYDRO-1-NAPHTHYL)PHENOXYPROPIONICACID, C-13437Su, CIBA-13437Su, Melipan, Su-13437, TPIA, 2-methyl-2-(4-tetralin-1-ylphenoxy)propionic acid, 2-Methyl-2-(4-(1,2,3,4-tetrahydro-1-naphthalenyl)phenoxy)propanoic acid, 2-Methyl-2-(4-(1,2,3,4-tetrahydro-1-naphthyl)phenoxy)propanoic acid, 2-Methyl-2-(p-(1,2,3,4-tetrahydro-1-naphthyl)phenoxy)propionic acid, alpha-Methyl-alpha-(p-1,2,3,4-tetrahydronaphth-1-ylphenoxy)propionic acid, BRN 2005820, C 13437 SU, CCRIS 421, CH 13-437, CH 13437, Ciba 13437 SU, Melipan, Nafenoic acid, Nafenopin, Nafenopine, Nafenopine [INN-French], Nafenopino, Nafenopino [INN-Spanish], Nafenopinum, Nafenopinum [INN-Latin], Propanoic acid, 2-methyl-2-(4-(1,2,3,4-tetrahydro-1-naphthalenyl)phenoxy)-, SU 13437, SU-13437, TPIA, UNII-093W78U96W, Nafenopin, Propanoic acid, 2-methyl-2-(4-(1,2,3,4-tetrahydro-1-naphthalenyl)phenoxy)-, Propionic acid, 2-methyl-2-(p-(1,2,3,4-tetrahydro-1-naphthyl)phenoxy)-, Superlist Names Nafenopin, Propanoic acid, 2-methyl-2-(4-(1,2,3,4-tetrahydro-1-naphthalenyl)phenoxy)-
Molecular weight310.39
SMILESC1(c2c(CCC1)cccc2)c1ccc(cc1)OC(C(=O)O)(C)C
CAS7496-02-8
FormulaC18H11NO2
Synonym6-NITROCHRYSENE, 84218, 6-Nitrochrysene (purity), 6-Nitrochrysene,99%
Molecular weight273.29
CAS61-57-4
FormulaC6H6N4O3S
Synonymniridazole, 1-(5-NITRO-2-THIAZOLYL)-2-IMIDAZOLIDINONE, 1-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one, Ambilhar, BA32644, Nitrothiamidazole, NSC-136947, 1-(5-nitrothiazol-2-yl)imidazolidin-2-one
Molecular weight214.20
EINECS200-512-6
CAS555-84-0
FormulaC8H8N4O4
SynonymNifuradene, (1-(5-nitro-2-furanyl)methyleneamino)imidazolin-2-one, [(5-NITROFURFURYLIDENE)AMINO]-2-IMIDAZOLIDINONE, NIFURADINE, 1((5-NITROFURFURYLIDENE)AMINO)-2-IMIDAZOLIDINONE, Nifuradene, 1-((5-Nitrofurfurilidene)amino)-2-imidazolidinone, 1-((5-Nitrofurfurylidene)amino)-2-imidazolidinone, 2-Imidazolidinone, 1-(((5-nitro-2-furanyl)methylene)amino)-, 2-Imidazolidinone, 1-(5-nitrofurfurylideneamino)-, 5-24-01-00157 (Beilstein Handbook Reference), BRN 0384793, CCRIS 445, N-(5-Nitro-2-furfurylidene)-1-amino-2-imidazolidone, N-(5-Nitro-2-furfurylideneamino)-2-imidazoaidinone, NF 246, NF-246, Nifuraden, Nifuradene, Nifuradeno, Nifuradeno [INN-Spanish], Nifuradenum, Nifuradenum [INN-Latin], Nifuradine, NSC 6470, NSC-6470, Oxafuradene, Oxafurandene, Oxifuradene, Oxyfuradene, Renafur, UNII-2VX65207DR, 1-((5-Nitrofurfurylidene)amino)-2-imidazolidinone, 2-Imidazolidinone, 1-(((5-nitro-2-furanyl)methylene)amino)-, 2-Imidazolidinone, 1-((5-nitrofurfurylidene)amino)-, Superlist Names 1-((5-Nitrofurfurylidene)amino)-2-imidazolidinone, 2-Imidazolidinone, 1-(((5-nitro-2-furanyl)methylene)amino)-
log P (octanol-water)0.240
Atmospheric OH Rate Constant2.20E-11 cm3/molecule-sec
Water solubility98.5 mg/L
Melting Point262 dec ° C
SMILESc1(oc([N+](=O)[O-])cc1)\C=N\N1C(NCC1)=O
CAS531-82-8
FormulaC9H7N3O4S
Synonymfurothiazole, N-(4-(5-NITRO-2-FURYL)-2-THIAZOLYL)ACETAMIDE, N-(4-(5-NITRO-2-FURYL)-THIAZOLYL)ACETAMIDE, NFTA, N-(4-(5-NITRO-2-FURYL)-2-THIAZOYL)ACETAMIDE, N-(4-(5-NITRO-2-FURANYL)-2-THIAZOLYL)-ACETAMIDE, N-[4-(5-Nitro-2-furyl)-2-thiazoly]acetamide, AS-17665, furothiazole
Molecular weight253.24
CAS126-85-2
FormulaC5H11CL2NO
SynonymNITROMIN, NITROGENMUSTARDN-OXIDE, MBAO, Mechlorethamine oxide, N,N-Bis(2-chloroethyl)methylamine oxide, Nitrogen mustard oxide, Oxy-NH2, bis(2-chloroethyl)(methyl)amine N-oxide, NITROMIN
CAS302-70-5
FormulaC5H12Cl3NO
Synonymchlormethine N-oxide hydrochloride, Mechlorethaminoxyde, NITROGENMUSTARDN-OXIDEHYDROCHLORIDE, MECHLORETHAMINE OXIDE HYDROCHLORIDE, mustine N-oxide hydrochloride, 2,2'-Dichloro-N-methyldiethylamine N-oxide hydrochloride, 2-Chloro-N-(2-chloroethyl)-N-methylethanamine-N-oxide hydrochloride, Chlormethine N-oxide HCl, chlormethine N-oxide hydrochloride
Molecular weight208.51
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-]
CAS60153-49-3
FormulaC4H7N3O
SynonymPropionitrile, 3-(methylnitrosamino)., 3-(methylnitrosamino)propionitrile, 3-(METHYLNITROSAMINO)PROPRIONITRILE, 3-(NITROSOMETHYLAMINO)-PROPIONITRILE, 3-(METHYLNITROSOAMINO)PROPIONITRILE, 3-(N-NITROSOMETHYLAMINO)PROPIONITRILE, 3-(Methylnitrosoamino)propiononitrile, 3-[Nitroso(methyl)amino]propanenitrile, Propionitrile, 3-(methylnitrosamino).
CAS64091-91-4
FormulaC10H13N3O2
Synonym4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK) solution, 4-(N-METHYL-N-NITROSOAMINO)-1-(3-PYRIDYL)-1-BUTANONE, 4-(N-NITROSOMETHYLAMINO)-1-(3-PYRIDYL)-1-BUTANONE, 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANONE, 4-(1-Methyl-2-oxohydrazino)-1-(3-pyridinyl)-1-butanone, 4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanon, 4-(nitrosoamino-n-methyl)-1-(3-pyridyl)-1-butanone, 4-(n-methyl-n-nitrosamino)-1-(3-pyridyl)-1-butanone, 4-(N-NITROSOMETHYLAMINO)-1-(3-PYRIDYL)-1-BUTANONE
Molecular weight207.23
CAS75881-22-0
SynonymN-nitrosomethyldecylamine, N-nitrosomethyldecylamine
CAS7068-83-9
FormulaC5H12N2O
SynonymMETHYLBUTYLNITROSAMINE, N-NITROSO-N-METHYLBUTYLAMINE, butylmethylnitrosamine, mbna, methyl-butyl-nitrosamin, methyl-n-butylnitrosamine, nitrosomethyl-n-butylamine, n-methyl-n-nitroso-butanamin, METHYLBUTYLNITROSAMINE, 4-04-00-03389 (Beilstein Handbook Reference), BRN 1701369, Butanamine, N-methyl-N-nitroso-, Butylmethylnitrosamine, CCRIS 1122, MBNA, Methyl-butyl-nitrosamin, Methyl-butyl-nitrosamin [German], Methyl-n-butylnitrosamine, Methylbutylnitrosamine, Methylbutylnitrosoamine, N-Butyl-N-methylnitrosamine, N-Methyl-N-nitrosobutylamine, N-Nitroso-n-butylmethylamine, N-Nitroso-N-methyl-N-n-butylamine, N-Nitrosomethyl-N-butylamine, Nitrosomethyl-n-butylamine, NMBA, UNII-F60APV88QL, Butylamine, N-methyl-N-nitroso-, N-Methyl-N-butylnitrosamine
Molecular weight116.16
SMILESN(CCCC)(N=O)C
Henry's Law Constant4.81E-06 atm-m3/mole
Vapor Pressure0.219 mm Hg
Atmospheric OH Rate Constant1.47E-11 cm3/molecule-sec
log P (octanol-water)1.08
Water solubility2.32E+04 mg/L
CAS55090-44-3
FormulaC13H28N2O
SynonymN-nitrosomethyldodecylamine, N-DODECYLMETHYLNITROSAMINE, N-NITROSOMETHYL-N-DODECYLAMINE, NITROSOMETHYLDODECYLAMINE, N-Methyl-N-dodecylnitrosamine, N-Methyl-N-nitroso-1-dodecanamine, N-Nitroso-N-methyl-1-dodecanamine, N-nitrosomethyldodecylamine
CAS16338-99-1
FormulaC8H18N2O
SynonymN-Nitrosomethyl-n-heptylamine, nitrosomethyl-N-heptylamine
Molecular weight158.24
CAS28538-70-7
FormulaC7H16N2O
SynonymN-Methyl-N-nitrosohexylamine, nitrosomethyl-N-hexylamine, Methylhexylnitrosamine, nitrosomethyl-N-hexylamine, 1-Hexanamine, N-methyl-N-nitroso-, BRN 2429386, CCRIS 3060, N-Methyl-N-nitrosohexylamine, Nitroso-n-hexylmethylamine, Nitrosomethyl-n-hexylamine, UNII-4VTR512J6G, Hexylamine, N-methyl-N-nitroso-, N-Nitrosomethyl-N-hexylamine
SMILESN(CCCCCC)(N=O)C
CAS75881-19-5
SynonymN-nitrosomethylnonylamine, N-nitrosomethylnonylamine
CAS34423-54-6
SynonymN-nitrosomethyloctylamine, NITROSOMETHYL-N-OCTYLAMINE, N-Methyl-N-nitrosooctylamine, N-nitrosomethyloctylamine
CAS13256-07-0
FormulaC6H14N2O
SynonymN-AMYL-N-METHYLNITROSAMINE, amn, methylamylnitrosamin, methylamylnitrosamine, methyl-n-amylnitrosamine, methyl-n-pentylnitrosamine, nitrosomethyl-n-amylamine, nitrosomethyl-n-pentylamine, N-AMYL-N-METHYLNITROSAMINE, AMN, BRN 1925624, CCRIS 3059, Methyl-N-amylnitrosamine, Methyl-N-pentylnitrosamine, Methylamylnitrosamin, Methylamylnitrosamin [German], Methylamylnitrosamine, N-Amyl-N-methylnitrosamine, N-Methyl-N-nitrosopentylamine, N-Methyl-N-pentylnitrosamine, N-Nitroso-N-methyl-n-amylamine, Nitrosomethyl-n-amylamine, Nitrosomethyl-n-pentylamine, 1-Pentanamine, N-methyl-N-nitroso-, N-Nitrosomethyl-N-amylamine, Pentylamine, N-methyl-N-nitroso-
Molecular weight130.19
SMILESN(CCCCC)(N=O)C
log P (octanol-water)1.330
Henry's Law Constant6.39E-06 atm-m3/mole
Atmospheric OH Rate Constant1.61E-11 cm3/molecule-sec
Vapor Pressure0.087 mm Hg
Water solubility6770 mg/L
CAS75881-20-8
FormulaC15H32N2O
SynonymN-NITROSO-N-METHYLTETRADECYLAMINE, N-METHYL-N-NITROSO TETRADECYLAMINE, n-methyl-n-nitroso-tetradecylamin, n-nitroso-n-methyl-n-tetradecylamine, N-nitrosomethyltetradecylamine, N-METHYL-N-NITROSO TETRADECYLAMINE
Molecular weight256.43
CAS68107-26-6
SynonymN-nitrosomethylundecylamine, NITROSOMETHYLUNDECYLAMINE, N-Methyl-N-nitrosoundecylamine, N-Methyl-N-undecylnitrosoamine, N-nitrosomethylundecylamine
CAS615-53-2
FormulaC4H8N2O3
Synonymnsc2860, N-Methyl-N-nitrosocarbamic acid ethyl, N-Ethoxycarbonyl-N-methylnitrosamine N-Nitroso-N-methylurethane Ethyl N-Methyl-N-nitrosocarbamate, rcrawastenumberu178, N-ETHOXYCARBONYL-N-METHYLNITROSAMINE, N-Methyl-N-nitrosocarbamic acid,ethyl ester, N-METHYL-N-NITROSOURETHANE, Nitrosomethyl urethane, 4-04-00-03385 (Beilstein Handbook Reference), AI3-19393, BRN 1763954, Carbamic acid, methylnitroso-, ethyl ester, Carbamic acid, N-methyl-N-nitroso-, ethyl ester, CCRIS 471, EINECS 210-432-3, Ethyl ester of methylnitroso-carbamic acid, Ethyl N-methylnitrosocarbamate, Ethylester kyseliny N-methyl-N-nitrosokarbaminove, Ethylester kyseliny N-methyl-N-nitrosokarbaminove [Czech], HSDB 5113, Methyl-N-nitrosourethane, Methylnitrosourethan, Methylnitrosourethan [German], Methylnitrosourethane, MNUN, N-Methyl-N-nitroso-urethane, N-Methyl-N-nitrosocarbamic acid, ethyl ester, N-Methyl-N-nitrosoethylcarbamate, N-Nitro-N-methylurethan, N-Nitroso-N-methylurethane, N-Nitrosomethylurethane, Nitrosomethylurethan, Nitrosomethylurethan [German], Nitrosomethylurethane, NM-Urethan, Nm-urethane, NMU, NMUT, NSC 2860, RCRA waste number U178, UNII-741GDM4803, Carbamic acid, methylnitroso-, ethyl ester, Carbamic acid, N-methyl-N-nitroso-, ethyl ester, Ethyl methylnitrosocarbamate, N-Nitroso-N-methylurethane, Superlist Names Carbamic acid, methylnitroso-, ethyl ester, N-Methyl-N-nitrosourethane, N-Nitroso-N-methylurethane, Nitrosomethylurethane, RCRA waste no. U178
Molecular weight132.12
SMILESC(N(N=O)C)(OCC)=O
Henry's Law Constant5.54E-06 atm-m3/mole
Atmospheric OH Rate Constant5.92E-12 cm3/molecule-sec
Water solubility3.70E+04 mg/L
log P (octanol-water)1.220
EINECS210-432-3
CAS4549-40-0
FormulaC3H6N2O
SynonymMethylvinylnitrosamine, N-Nitrosomethylvinylamine., N-nitroso-N-methylvinylamine, N-METHYL-N-VINYLNITROSAMINE, Vinylamine,N-methyl-N-nitroso-, Methylvinylnitrosoamine, N-Methyl-N-nitrosovinylamine, N-ethenyl-N-methylnitrous amide, Methylvinylnitrosamine
Molecular weight86.09
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