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183174-36-9 | Methanone, (4-mercaptophenyl)-1-naphthalenyl-
CAS No: 183174-36-9 Catalog No: AG0027E0 MDL No:
Product Description
Catalog Number:
AG0027E0
Chemical Name:
Methanone, (4-mercaptophenyl)-1-naphthalenyl-
CAS Number:
183174-36-9
Molecular Formula:
C17H12OS
Molecular Weight:
264.3416
IUPAC Name:
naphthalen-1-yl-(4-sulfanylphenyl)methanone
InChI:
InChI=1S/C17H12OS/c18-17(13-8-10-14(19)11-9-13)16-7-3-5-12-4-1-2-6-15(12)16/h1-11,19H
InChI Key:
OURZXOZFYQRSCT-UHFFFAOYSA-N
SMILES:
Sc1ccc(cc1)C(=O)c1cccc2c1cccc2
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.342g/mol
Monoisotopic Mass:
264.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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