200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 88660-88-2
88660-88-2 | Butanedioic acid, (2-ethyl-4-methyl-1H-imidazol-1-yl)-
CAS No: 88660-88-2 Catalog No: AG0048IB MDL No:
Product Description
Catalog Number:
AG0048IB
Chemical Name:
Butanedioic acid, (2-ethyl-4-methyl-1H-imidazol-1-yl)-
CAS Number:
88660-88-2
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
IUPAC Name:
2-(2-ethyl-4-methylimidazol-1-yl)butanedioic acid
InChI:
InChI=1S/C10H14N2O4/c1-3-8-11-6(2)5-12(8)7(10(15)16)4-9(13)14/h5,7H,3-4H2,1-2H3,(H,13,14)(H,15,16)
InChI Key:
YAAOUSNBAUQPLW-UHFFFAOYSA-N
SMILES:
CCc1nc(cn1C(C(=O)O)CC(=O)O)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.232g/mol
Monoisotopic Mass:
226.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.