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16212-08-1 | Benzene, 1-methyl-4-[[(1E)-2-phenylethenyl]sulfonyl]-
CAS No: 16212-08-1 Catalog No: AG001SRV MDL No:
Product Description
Catalog Number:
AG001SRV
Chemical Name:
Benzene, 1-methyl-4-[[(1E)-2-phenylethenyl]sulfonyl]-
CAS Number:
16212-08-1
Molecular Formula:
C15H14O2S
Molecular Weight:
258.3355
IUPAC Name:
1-methyl-4-[(E)-2-phenylethenyl]sulfonylbenzene
InChI:
InChI=1S/C15H14O2S/c1-13-7-9-15(10-8-13)18(16,17)12-11-14-5-3-2-4-6-14/h2-12H,1H3/b12-11+
InChI Key:
PIALZYNUNCIZLT-VAWYXSNFSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)/C=C/c1ccccc1
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
258.071g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.335g/mol
Monoisotopic Mass:
258.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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