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2- (2-Bromophenyl) -N-methylacetamide

CAT: 0024-sc-298035Size: 1 gDry Ice: NoHazardous: No
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CAS Number
141438-47-3

Chemical Information

2-(2-Bromophenyl)-N-methylacetamide
CAS Number141438-47-3
PubChem CID18367523
IUPAC Name2-(2-bromophenyl)-N-methylacetamide
Molecular FormulaC9H10BrNO
Molecular Weight228.09
XLogP1.8
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity161
SMILES
CNC(=O)CC1=CC=CC=C1Br
InChI
InChI=1S/C9H10BrNO/c1-11-9(12)6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3,(H,11,12)
InChIKey
GLJWLOQCRSVLGH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Bromophenyl)-N-methylacetamide
CAS: 141438-47-3
CID: 18367523
Formula: C9H10BrNO
MW: 228.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.09
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass226.99458
Monoisotopic Mass226.99458
Topological Polar Surface Area29.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity161
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

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