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13232-76-3 | 3H-1,2-Dithiole-3-thione, 4,5-diphenyl-
CAS No: 13232-76-3 Catalog No: AG0010KB MDL No:
Product Description
Catalog Number:
AG0010KB
Chemical Name:
3H-1,2-Dithiole-3-thione, 4,5-diphenyl-
CAS Number:
13232-76-3
Molecular Formula:
C15H10S3
Molecular Weight:
286.4349
IUPAC Name:
4,5-diphenyldithiole-3-thione
InChI:
InChI=1S/C15H10S3/c16-15-13(11-7-3-1-4-8-11)14(17-18-15)12-9-5-2-6-10-12/h1-10H
InChI Key:
ILAXRAVUQIJKLV-UHFFFAOYSA-N
SMILES:
S=c1ssc(c1c1ccccc1)c1ccccc1
NSC Number:
149665
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.994g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.425g/mol
Monoisotopic Mass:
285.994g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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