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951887-16-4 | 2-Bromo-3-(5-methyl-2-pyridyl)-1-propene
CAS No: 951887-16-4 Catalog No: AG01EZQ3 MDL No:
Product Description
Catalog Number:
AG01EZQ3
Chemical Name:
2-Bromo-3-(5-methyl-2-pyridyl)-1-propene
CAS Number:
951887-16-4
Molecular Formula:
C9H10BrN
Molecular Weight:
212.0864
IUPAC Name:
2-(2-bromoprop-2-enyl)-5-methylpyridine
InChI:
InChI=1S/C9H10BrN/c1-7-3-4-9(11-6-7)5-8(2)10/h3-4,6H,2,5H2,1H3
InChI Key:
FWQWGNFGTLMHQE-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1ccc(cn1)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.09g/mol
Monoisotopic Mass:
211g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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