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1019453-85-0 | Benzenamine, 2-[(2,4-dimethylphenyl)thio]-
CAS No: 1019453-85-0 Catalog No: AG00060Y MDL No:MFCD11132336
Product Description
Catalog Number:
AG00060Y
Chemical Name:
Benzenamine, 2-[(2,4-dimethylphenyl)thio]-
CAS Number:
1019453-85-0
Molecular Formula:
C14H15NS
Molecular Weight:
229.3406
MDL Number:
MFCD11132336
IUPAC Name:
2-(2,4-dimethylphenyl)sulfanylaniline
InChI:
InChI=1S/C14H15NS/c1-10-7-8-13(11(2)9-10)16-14-6-4-3-5-12(14)15/h3-9H,15H2,1-2H3
InChI Key:
BJHMYQKFVFJZDC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)Sc1ccccc1N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.093g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.341g/mol
Monoisotopic Mass:
229.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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