200,000+ products from a single source!
sales@angenechem.com
857939-28-7 | 1H-Imidazole-5-carboxylicacid, 4-(2-aminoethyl)-2-methyl-
CAS No: 857939-28-7 Catalog No: AG004RM9 MDL No:
Product Description
Catalog Number:
AG004RM9
Chemical Name:
1H-Imidazole-5-carboxylicacid, 4-(2-aminoethyl)-2-methyl-
CAS Number:
857939-28-7
Molecular Formula:
C7H11N3O2
Molecular Weight:
169.1811
IUPAC Name:
5-(2-aminoethyl)-2-methyl-1H-imidazole-4-carboxylic acid
InChI:
InChI=1S/C7H11N3O2/c1-4-9-5(2-3-8)6(10-4)7(11)12/h2-3,8H2,1H3,(H,9,10)(H,11,12)
InChI Key:
VBYWBELSVGCZJI-UHFFFAOYSA-N
SMILES:
Cc1nc(c([nH]1)C(=O)O)CCN
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.085g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
169.184g/mol
Monoisotopic Mass:
169.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.