Name: Name:2-(2-Nitro-1H-imidazol-1-yl)acetic acid
Brand: Angene
SKU: AG0037RV
Rating: 90 (10 reviews)

2-(2-Nitro-1H-imidazol-1-yl)acetic acid

CAS No.:

22813-32-7

Catalog Number:

AG0037RV

Molecular Formula:

C5H5N3O4

Molecular Weight:

171.1109

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Product Description

Catalog Number:

AG0037RV

Chemical Name:

2-(2-Nitro-1H-imidazol-1-yl)acetic acid

CAS Number:

22813-32-7

Molecular Formula:

C5H5N3O4

Molecular Weight:

171.1109

MDL Number:

MFCD12022607

IUPAC Name:

2-(2-nitroimidazol-1-yl)acetic acid

InChI:

InChI=1S/C5H5N3O4/c9-4(10)3-7-2-1-6-5(7)8(11)12/h1-2H,3H2,(H,9,10)

InChI Key:

TYDGDUVFDYKZMY-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1ccnc1[N+](=O)[O-]

NSC Number:

302988

Properties

Complexity:

201

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

171.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

171.112g/mol

Monoisotopic Mass:

171.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties