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951885-50-0

951885-50-0 | 4-(Ethylthio)-2'-iodobenzophenone

CAS No: 951885-50-0 Catalog No: AG01EZNI MDL No:

Product Description

Catalog Number:
AG01EZNI
Chemical Name:
4-(Ethylthio)-2'-iodobenzophenone
CAS Number:
951885-50-0
Molecular Formula:
C15H13IOS
Molecular Weight:
368.2326
IUPAC Name:
(4-ethylsulfanylphenyl)-(2-iodophenyl)methanone
InChI:
InChI=1S/C15H13IOS/c1-2-18-12-9-7-11(8-10-12)15(17)13-5-3-4-6-14(13)16/h3-10H,2H2,1H3
InChI Key:
BUPXPVQKZSGEPD-UHFFFAOYSA-N
SMILES:
CCSc1ccc(cc1)C(=O)c1ccccc1I

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.973g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.232g/mol
Monoisotopic Mass:
367.973g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

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