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31378-03-7 | 1-Phenyl-2-tosylethanone
CAS No: 31378-03-7 Catalog No: AG003F49 MDL No:MFCD00026002
Product Description
Catalog Number:
AG003F49
Chemical Name:
1-Phenyl-2-tosylethanone
CAS Number:
31378-03-7
Molecular Formula:
C15H14O3S
Molecular Weight:
274.3349
MDL Number:
MFCD00026002
IUPAC Name:
2-(4-methylphenyl)sulfonyl-1-phenylethanone
InChI:
InChI=1S/C15H14O3S/c1-12-7-9-14(10-8-12)19(17,18)11-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3
InChI Key:
RFQXSRPFYWMUDV-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)CC(=O)c1ccccc1
EC Number:
250-605-0
NSC Number:
140338
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.066g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.334g/mol
Monoisotopic Mass:
274.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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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