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1755-74-4 | Methanone, [2-(phenylmethyl)phenyl]-2-thienyl-
CAS No: 1755-74-4 Catalog No: AG00210O MDL No:
Product Description
Catalog Number:
AG00210O
Chemical Name:
Methanone, [2-(phenylmethyl)phenyl]-2-thienyl-
CAS Number:
1755-74-4
Molecular Formula:
C18H14OS
Molecular Weight:
278.3682
IUPAC Name:
(2-benzylphenyl)-thiophen-2-ylmethanone
InChI:
InChI=1S/C18H14OS/c19-18(17-11-6-12-20-17)16-10-5-4-9-15(16)13-14-7-2-1-3-8-14/h1-12H,13H2
InChI Key:
HECRUKBEHGGNIR-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1Cc1ccccc1)c1cccs1
NSC Number:
99466
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.077g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.369g/mol
Monoisotopic Mass:
278.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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