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88070-23-9 | Benzenamine, 4,4'-dithiobis[2-methyl-
CAS No: 88070-23-9 Catalog No: AG004HWR MDL No:
Product Description
Catalog Number:
AG004HWR
Chemical Name:
Benzenamine, 4,4'-dithiobis[2-methyl-
CAS Number:
88070-23-9
Molecular Formula:
C14H16N2S2
Molecular Weight:
276.4202
IUPAC Name:
4-[(4-amino-3-methylphenyl)disulfanyl]-2-methylaniline
InChI:
InChI=1S/C14H16N2S2/c1-9-7-11(3-5-13(9)15)17-18-12-4-6-14(16)10(2)8-12/h3-8H,15-16H2,1-2H3
InChI Key:
RCBDJCNMMCFWNV-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C)SSc1ccc(c(c1)C)N
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.416g/mol
Monoisotopic Mass:
276.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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