Name: Name:1H-Imidazole-1-propanoicacid, 2-methyl-4-nitro-
Brand: Angene
SKU: AG007AMJ
Rating: 90 (10 reviews)

1H-Imidazole-1-propanoicacid, 2-methyl-4-nitro-

CAS No.:

16935-04-9

Catalog Number:

AG007AMJ

Molecular Formula:

C7H9N3O4

Molecular Weight:

199.1641

Catalog Number:

AG007AMJ

Chemical Name:

1H-Imidazole-1-propanoicacid, 2-methyl-4-nitro-

CAS Number:

16935-04-9

Molecular Formula:

C7H9N3O4

Molecular Weight:

199.1641

MDL Number:

MFCD00134515

IUPAC Name:

3-(2-methyl-4-nitroimidazol-1-yl)propanoic acid

InChI:

InChI=1S/C7H9N3O4/c1-5-8-6(10(13)14)4-9(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)

InChI Key:

QIJTUXYFQLHGJI-UHFFFAOYSA-N

SMILES:

OC(=O)CCn1cc(nc1C)[N+](=O)[O-]

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.166g/mol

Monoisotopic Mass:

199.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4