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10038-08-1 | Benzene, [dichloro[(phenylmethyl)sulfonyl]methyl]-
CAS No: 10038-08-1 Catalog No: AG0001TQ MDL No:
Product Description
Catalog Number:
AG0001TQ
Chemical Name:
Benzene, [dichloro[(phenylmethyl)sulfonyl]methyl]-
CAS Number:
10038-08-1
Molecular Formula:
C14H12Cl2O2S
Molecular Weight:
315.2149
IUPAC Name:
[dichloro(phenyl)methyl]sulfonylmethylbenzene
InChI:
InChI=1S/C14H12Cl2O2S/c15-14(16,13-9-5-2-6-10-13)19(17,18)11-12-7-3-1-4-8-12/h1-10H,11H2
InChI Key:
MTTPKLOSMYAEAE-UHFFFAOYSA-N
SMILES:
ClC(S(=O)(=O)Cc1ccccc1)(c1ccccc1)Cl
NSC Number:
109919
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.994g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.208g/mol
Monoisotopic Mass:
313.994g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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