CSC1=CC=CC(=C1)N
CAS: 1783-81-9
Name: 3-methylsulfanylaniline
SMILES: CSC1=CC=CC(=C1)N

Molecular Processing

Molecular formula
C7H9NS
Molecular weight
139.22
Exact mass
139.0456
XLogP
1.99
TPSA
26.02
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
42.64

Supplementary Information

InChIKey: KCHLDNLIJVSRPK-UHFFFAOYSA-N
Synonyme
3-(Methylthio)aniline3-AminothioanisoleBenzenamine, 3-(methylthio)-m-Aminothioanisole3-Methylmercaptoaniline3-Methylthiobenzenaminem-Aminophenyl methyl sulfideANILINE, m-(METHYLTHIO)-NSC 66274EINECS 217-232-5BRN 20785993-(METHYLTHIO)BENZENAMINE4-13-00-01007 (Beilstein Handbook Reference)RefChem:561715217-232-51783-81-9m-(Methylthio)aniline3-methylsulfanylaniline3-(Methylmercapto)aniline3-(Methylsulfanyl)anilineMFCD000077933-methylthiophenylamineAniline, 3-methylthio-NSC-66274m-Thioanisidinem-METHYLTHIOANILINE3-methylthioaniline3-METHYLSULFANYL-PHENYLAMINENSC662743-Methylthio-aniline
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