Name: Name:3-Bromo-1-methyl-5-nitropyridin-2(1H)-one
Brand: Angene
SKU: AG01EN4H
Rating: 90 (10 reviews)

3-Bromo-1-methyl-5-nitropyridin-2(1H)-one

CAS No.:

16098-21-8

Catalog Number:

AG01EN4H

Molecular Formula:

C6H5BrN2O3

Molecular Weight:

233.0195

Catalog Number:

AG01EN4H

Chemical Name:

3-Bromo-1-methyl-5-nitropyridin-2(1H)-one

CAS Number:

16098-21-8

Molecular Formula:

C6H5BrN2O3

Molecular Weight:

233.0195

MDL Number:

MFCD27945622

IUPAC Name:

3-bromo-1-methyl-5-nitropyridin-2-one

InChI:

InChI=1S/C6H5BrN2O3/c1-8-3-4(9(11)12)2-5(7)6(8)10/h2-3H,1H3

InChI Key:

TVMGAVXSPUAAJH-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cn(C)c(=O)c(c1)Br

Complexity:

302

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.948g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.021g/mol

Monoisotopic Mass:

231.948g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8