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2615-09-0

2615-09-0 | Ethanone, 1,1'-(thiodi-4,1-phenylene)bis-

CAS No: 2615-09-0 Catalog No: AG002RVD MDL No:

Product Description

Catalog Number:
AG002RVD
Chemical Name:
Ethanone, 1,1'-(thiodi-4,1-phenylene)bis-
CAS Number:
2615-09-0
Molecular Formula:
C16H14O2S
Molecular Weight:
270.3462
IUPAC Name:
1-[4-(4-acetylphenyl)sulfanylphenyl]ethanone
InChI:
InChI=1S/C16H14O2S/c1-11(17)13-3-7-15(8-4-13)19-16-9-5-14(6-10-16)12(2)18/h3-10H,1-2H3
InChI Key:
JBDYORUCEWAWQR-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)Sc1ccc(cc1)C(=O)C

Properties

Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.071g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.346g/mol
Monoisotopic Mass:
270.071g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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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