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187963-91-3 | Methanone, (3-bromophenyl)-3-thienyl-
CAS No: 187963-91-3 Catalog No: AG002GL1 MDL No:
Product Description
Catalog Number:
AG002GL1
Chemical Name:
Methanone, (3-bromophenyl)-3-thienyl-
CAS Number:
187963-91-3
Molecular Formula:
C11H7BrOS
Molecular Weight:
267.1417
IUPAC Name:
(3-bromophenyl)-thiophen-3-ylmethanone
InChI:
InChI=1S/C11H7BrOS/c12-10-3-1-2-8(6-10)11(13)9-4-5-14-7-9/h1-7H
InChI Key:
GHCSNYCUSDAYOB-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(=O)c1cscc1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.94g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.14g/mol
Monoisotopic Mass:
265.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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