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951885-99-7 | 3-(3-Bromo-2-thienyl)-2-methyl-1-propene
CAS No: 951885-99-7 Catalog No: AG01EZO5 MDL No:
Product Description
Catalog Number:
AG01EZO5
Chemical Name:
3-(3-Bromo-2-thienyl)-2-methyl-1-propene
CAS Number:
951885-99-7
Molecular Formula:
C8H9BrS
Molecular Weight:
217.1261
IUPAC Name:
3-bromo-2-(2-methylprop-2-enyl)thiophene
InChI:
InChI=1S/C8H9BrS/c1-6(2)5-8-7(9)3-4-10-8/h3-4H,1,5H2,2H3
InChI Key:
IFQJGQIJOAXEJZ-UHFFFAOYSA-N
SMILES:
CC(=C)Cc1sccc1Br
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.961g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.124g/mol
Monoisotopic Mass:
215.961g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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