2-Bromo-N-Methylisonicotinamide

CAT: 0127-OR1079615-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1079615-01Size:250 mg

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CAS Number

337536-01-3

Purity

98%

Smiles

CNC (=O) C1=CC (=NC=C1) Br

Chemical Information

2-Bromo-N-methylisonicotinamide

CAS Number	337536-01-3
PubChem CID	2762473
IUPAC Name	2-bromo-N-methylpyridine-4-carboxamide
Molecular Formula	C7H7BrN2O
Molecular Weight	215.05
XLogP	1
Topological Polar Surface Area	42
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	151

SMILES

CNC(=O)C1=CC(=NC=C1)Br

InChI

InChI=1S/C7H7BrN2O/c1-9-7(11)5-2-3-10-6(8)4-5/h2-4H,1H3,(H,9,11)

InChIKey

VHTGUQFOXREDMP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 337536-01-3

CID: 2762473

Formula: C7H7BrN2O

MW: 215.05

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	215.05
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	213.97418
Monoisotopic Mass	213.97418
Topological Polar Surface Area	42 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR91607-01	2-Bromo-N-methoxy-N-methylisonicotinamide
OR1033888-01	5-Bromo-2-chloro-N-methylisonicotinamide
PC1016935-01	2-Bromo-3-fluoro-N-methylisonicotinamide
OR1089479-01	5-Bromo-2-methoxy-N-methylisonicotinamide
OR1089540-01	5-Bromo-N,2-dimethoxy-N-methylisonicotinamide
OR88001-01	5-Bromo-2-chloro-N-methoxy-N-methylisonicotinamide
OR1098446-01	N-methylisonicotinamide
OR76894-01	2-Amino-N-methylisonicotinamide
OR907545-01	N,2-Dimethoxy-N-methylisonicotinamide
PC53926	2-Fluoro-N-methoxy-N-methylisonicotinamide

Catalog	Name
sc-321630A	2-Bromo-N-methylisonicotinamide
459497-01	N-Methylisonicotinamide
sc-283099	2-chloro-N-methylisonicotinamide
459722-01	N,2-Dimethoxy-N-methylisonicotinamide
459498	N-Methylisonicotinamide-d3
UAA35404-01	2-Methylisonicotinamide
BKA10136	3-Methylisonicotinamide
NAA88750-01	2-Bromo-N, N,2-trimethylpropanamide
416282-01	2-Bromo-n, n-dimethylacetamide
abx180302-01	2-Bromo-n,n-dimethylacetamide