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88649-72-3 | Benzene, [(2,2-dichloro-1-phenylethenyl)thio]-
CAS No: 88649-72-3 Catalog No: AG0048M9 MDL No:
Product Description
Catalog Number:
AG0048M9
Chemical Name:
Benzene, [(2,2-dichloro-1-phenylethenyl)thio]-
CAS Number:
88649-72-3
Molecular Formula:
C14H10Cl2S
Molecular Weight:
281.2002
IUPAC Name:
(2,2-dichloro-1-phenylethenyl)sulfanylbenzene
InChI:
InChI=1S/C14H10Cl2S/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1-10H
InChI Key:
HBJRPFFEEUZRPH-UHFFFAOYSA-N
SMILES:
ClC(=C(c1ccccc1)Sc1ccccc1)Cl
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.988g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.194g/mol
Monoisotopic Mass:
279.988g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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