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823213-45-2 | Benzene, 1-[(1-chloro-2-phenylethenyl)sulfinyl]-4-methyl-
CAS No: 823213-45-2 Catalog No: AG0054J6 MDL No:
Product Description
Catalog Number:
AG0054J6
Chemical Name:
Benzene, 1-[(1-chloro-2-phenylethenyl)sulfinyl]-4-methyl-
CAS Number:
823213-45-2
Molecular Formula:
C15H13ClOS
Molecular Weight:
276.7811
IUPAC Name:
1-(1-chloro-2-phenylethenyl)sulfinyl-4-methylbenzene
InChI:
InChI=1S/C15H13ClOS/c1-12-7-9-14(10-8-12)18(17)15(16)11-13-5-3-2-4-6-13/h2-11H,1H3
InChI Key:
IABIEGMYUFLKRU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)C(=Cc1ccccc1)Cl
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.038g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.778g/mol
Monoisotopic Mass:
276.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.3
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