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15753-89-6 | Benzene, [(ethenylsulfonyl)methyl]-
CAS No: 15753-89-6 Catalog No: AG001PIT MDL No:
Product Description
Catalog Number:
AG001PIT
Chemical Name:
Benzene, [(ethenylsulfonyl)methyl]-
CAS Number:
15753-89-6
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
IUPAC Name:
ethenylsulfonylmethylbenzene
InChI:
InChI=1S/C9H10O2S/c1-2-12(10,11)8-9-6-4-3-5-7-9/h2-7H,1,8H2
InChI Key:
CYHFPQIAMFXACF-UHFFFAOYSA-N
SMILES:
C=CS(=O)(=O)Cc1ccccc1
NSC Number:
220042
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.237g/mol
Monoisotopic Mass:
182.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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