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15848-07-4 | Methanethione, diphenyl-, S-oxide
CAS No: 15848-07-4 Catalog No: AG001Q8D MDL No:
Product Description
Catalog Number:
AG001Q8D
Chemical Name:
Methanethione, diphenyl-, S-oxide
CAS Number:
15848-07-4
Molecular Formula:
C13H10OS
Molecular Weight:
214.2829
IUPAC Name:
[phenyl(sulfinyl)methyl]benzene
InChI:
InChI=1S/C13H10OS/c14-15-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChI Key:
FNNSWZAKAFPQOO-UHFFFAOYSA-N
SMILES:
O=S=C(c1ccccc1)c1ccccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.282g/mol
Monoisotopic Mass:
214.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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