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Home > Imidazoles > 19920-34-4
19920-34-4 | 1H-Imidazole-4-hexanoic acid, 2,3-dihydro-5-methyl-ε,2-dioxo-
CAS No: 19920-34-4 Catalog No: AG002BZP MDL No:MFCD01909723
Product Description
Catalog Number:
AG002BZP
Chemical Name:
1H-Imidazole-4-hexanoic acid, 2,3-dihydro-5-methyl-ε,2-dioxo-
CAS Number:
19920-34-4
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
MDL Number:
MFCD01909723
IUPAC Name:
6-(5-methyl-2-oxo-1,3-dihydroimidazol-4-yl)-6-oxohexanoic acid
InChI:
InChI=1S/C10H14N2O4/c1-6-9(12-10(16)11-6)7(13)4-2-3-5-8(14)15/h2-5H2,1H3,(H,14,15)(H2,11,12,16)
InChI Key:
QOKBZTDZIZMTMS-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1C
EC Number:
243-426-4
Properties
Complexity:
360
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:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
226.232g/mol
Monoisotopic Mass:
226.095g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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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