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Home > Imidazoles > 57610-38-5
57610-38-5 | 2-ETHYL-1H-IMIDAZOLE-4,5-DICARBONITRILE
CAS No: 57610-38-5 Catalog No: AG00EIXX MDL No:MFCD06496123
Product Description
Catalog Number:
AG00EIXX
Chemical Name:
2-ETHYL-1H-IMIDAZOLE-4,5-DICARBONITRILE
CAS Number:
57610-38-5
Molecular Formula:
C7H6N4
Molecular Weight:
146.1493
MDL Number:
MFCD06496123
IUPAC Name:
2-ethyl-1H-imidazole-4,5-dicarbonitrile
InChI:
InChI=1S/C7H6N4/c1-2-7-10-5(3-8)6(4-9)11-7/h2H2,1H3,(H,10,11)
InChI Key:
JBGUQPNUGTYMCR-UHFFFAOYSA-N
SMILES:
CCc1nc(c([nH]1)C#N)C#N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.153g/mol
Monoisotopic Mass:
146.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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 |
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