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20608-84-8 | 3-(3-Bromo-phenyl)-thiophene
CAS No: 20608-84-8 Catalog No: AG01FFBO MDL No:
Product Description
Catalog Number:
AG01FFBO
Chemical Name:
3-(3-Bromo-phenyl)-thiophene
CAS Number:
20608-84-8
Molecular Formula:
C10H7BrS
Molecular Weight:
239.1316
IUPAC Name:
3-(3-bromophenyl)thiophene
InChI:
InChI=1S/C10H7BrS/c11-10-3-1-2-8(6-10)9-4-5-12-7-9/h1-7H
InChI Key:
NLTNNCCVVGSEQK-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)c1cscc1
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.945g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.13g/mol
Monoisotopic Mass:
237.945g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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