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2- (Bromomethyl) -6-methylpyridine

CAT: 0024-sc-254063Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-254063Size:1 g
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CAS Number
68470-59-7

Chemical Information

2-(Bromomethyl)-6-methylpyridine
CAS Number68470-59-7
PubChem CID12543733
IUPAC Name2-(bromomethyl)-6-methylpyridine
Molecular FormulaC7H8BrN
Molecular Weight186.05
XLogP1.8
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity85
SMILES
CC1=NC(=CC=C1)CBr
InChI
InChI=1S/C7H8BrN/c1-6-3-2-4-7(5-8)9-6/h2-4H,5H2,1H3
InChIKey
WJFDCFHWFHCLIW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Bromomethyl)-6-methylpyridine
CAS: 68470-59-7
CID: 12543733
Formula: C7H8BrN
MW: 186.05
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight186.05
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass184.98401
Monoisotopic Mass184.98401
Topological Polar Surface Area12.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity85
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes