200,000+ products from a single source!
sales@angenechem.com
144776-84-1 | 1H-Imidazole-4-carboxylic acid, 2-amino-4,5-dihydro-4-hydroxy-5-oxo-, ethyl ester
CAS No: 144776-84-1 Catalog No: AG001K5W MDL No:
Product Description
Catalog Number:
AG001K5W
Chemical Name:
1H-Imidazole-4-carboxylic acid, 2-amino-4,5-dihydro-4-hydroxy-5-oxo-, ethyl ester
CAS Number:
144776-84-1
Molecular Formula:
C6H9N3O4
Molecular Weight:
187.1534
IUPAC Name:
ethyl 2-amino-4-hydroxy-5-oxo-1H-imidazole-4-carboxylate
InChI:
InChI=1S/C6H9N3O4/c1-2-13-4(11)6(12)3(10)8-5(7)9-6/h12H,2H2,1H3,(H3,7,8,9,10)
InChI Key:
XSTQILLZHNVNHR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(O)N=C(NC1=O)N
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
187.155g/mol
Monoisotopic Mass:
187.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.