200,000+ products from a single source!
sales@angenechem.com
1564-49-4 | 1H-Imidazole-2-carboxylic acid, 1-methyl-5-nitro-, ethyl ester
CAS No: 1564-49-4 Catalog No: AG001OQ1 MDL No:MFCD03789116
Product Description
Catalog Number:
AG001OQ1
Chemical Name:
1H-Imidazole-2-carboxylic acid, 1-methyl-5-nitro-, ethyl ester
CAS Number:
1564-49-4
Molecular Formula:
C7H9N3O4
Molecular Weight:
199.1641
MDL Number:
MFCD03789116
IUPAC Name:
ethyl 1-methyl-5-nitroimidazole-2-carboxylate
InChI:
InChI=1S/C7H9N3O4/c1-3-14-7(11)6-8-4-5(9(6)2)10(12)13/h4H,3H2,1-2H3
InChI Key:
IFMBEWCVGFBHPO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(n1C)C(=O)OCC
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.166g/mol
Monoisotopic Mass:
199.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.