3-Aminothioanisole
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Product Description
Product
3-Aminothioanisole
CAS
1783-81-9
Formula
C7H9NS
Synonym
Benzenamine, 3-(methylthio)-; 3-Aminothioanisole; 3-CH3SC6H4NH2; 3-Methylmercaptoaniline; 3-Methylthiobenzenamine; 4-13-00-01007 (Beilstein Handbook Reference); Aniline, 3-methylthio-; Aniline, m-(methylthio)-; BRN 2078599; EINECS 217-232-5; m-(Methylthio)aniline; m-Aminophenyl methyl sulfide; m-Aminothioanisole; NSC 66274; 3-(Methylsulfanyl)phenylamine; 3-(Methylthio)aniline
Typical Product Specifications
Molecular weight
139.22
SMILES
c1(cc(ccc1)N)SC
InChI
1S/C7H9NS/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H3
InChIKey
KCHLDNLIJVSRPK-UHFFFAOYSA-N
Atmospheric OH Rate Constant
2.01E-10 cm3/molecule-sec
Vapor Pressure
0.012 mm Hg
pKa Dissociation Constant
4
log P (octanol-water)
1.45
Henry's Law Constant
5.55E-08 atm-m3/mole
Water solubility
4870 mg/L
Class
3-Aminothioanisole
Product Description
Product
3-Aminothioanisole
CAS
1783-81-9
Formula
C7H9NS
Synonym
Benzenamine, 3-(methylthio)-; 3-Aminothioanisole; 3-CH3SC6H4NH2; 3-Methylmercaptoaniline; 3-Methylthiobenzenamine; 4-13-00-01007 (Beilstein Handbook Reference); Aniline, 3-methylthio-; Aniline, m-(methylthio)-; BRN 2078599; EINECS 217-232-5; m-(Methylthio)aniline; m-Aminophenyl methyl sulfide; m-Aminothioanisole; NSC 66274; 3-(Methylsulfanyl)phenylamine; 3-(Methylthio)aniline
Typical Product Specifications
Molecular weight
139.22
SMILES
c1(cc(ccc1)N)SC
InChI
1S/C7H9NS/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H3
InChIKey
KCHLDNLIJVSRPK-UHFFFAOYSA-N
Atmospheric OH Rate Constant
2.01E-10 cm3/molecule-sec
Vapor Pressure
0.012 mm Hg
pKa Dissociation Constant
4
log P (octanol-water)
1.45
Henry's Law Constant
5.55E-08 atm-m3/mole
Water solubility
4870 mg/L
Class
