Home Other Building Blocks 2-methyl-3-(phenylsulfanyl)aniline

2-methyl-3-(phenylsulfanyl)aniline

CAS No.:
1344215-25-3
Catalog Number:
AG01AG9R
Molecular Formula:
C13H13NS
Molecular Weight:
215.3140
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Product Description
Catalog Number:
AG01AG9R
Chemical Name:
2-methyl-3-(phenylsulfanyl)aniline
CAS Number:
1344215-25-3
Molecular Formula:
C13H13NS
Molecular Weight:
215.3140
MDL Number:
MFCD17285192
IUPAC Name:
2-methyl-3-phenylsulfanylaniline
InChI:
InChI=1S/C13H13NS/c1-10-12(14)8-5-9-13(10)15-11-6-3-2-4-7-11/h2-9H,14H2,1H3
InChI Key:
YFZPBQSQPNMFJE-UHFFFAOYSA-N
SMILES:
Cc1c(cccc1N)Sc1ccccc1
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.077g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.314g/mol
Monoisotopic Mass:
215.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties