Name: Name:METRONIDAZOLE-D4
Brand: Angene
SKU: AG009GG9
Rating: 90 (10 reviews)

METRONIDAZOLE-D4

CAS No.:

1261392-47-5

Catalog Number:

AG009GG9

Molecular Formula:

C6H5D4N3O3

Molecular Weight:

175.1786

Catalog Number:

AG009GG9

Chemical Name:

METRONIDAZOLE-D4

CAS Number:

1261392-47-5

Molecular Formula:

C6H5D4N3O3

Molecular Weight:

175.1786

IUPAC Name:

1,1,2,2-tetradeuterio-2-(2-methyl-5-nitroimidazol-1-yl)ethanol

InChI:

InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3/i2D2,3D2

InChI Key:

VAOCPAMSLUNLGC-RRVWJQJTSA-N

SMILES:

[O-][N+](=O)c1cnc(n1C(C(O)([2H])[2H])([2H])[2H])C

Complexity:

170

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.18g/mol

Monoisotopic Mass:

175.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: