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Home > Imidazoles > 60718-46-9
60718-46-9 | 6-(1H-imidazol-1-yl)-6-oxohexanoic acid
CAS No: 60718-46-9 Catalog No: AG00EX4U MDL No:
Product Description
Catalog Number:
AG00EX4U
Chemical Name:
6-(1H-imidazol-1-yl)-6-oxohexanoic acid
CAS Number:
60718-46-9
IUPAC Name:
6-imidazol-1-yl-6-oxohexanoic acid
InChI:
InChI=1S/C9H12N2O3/c12-8(11-6-5-10-7-11)3-1-2-4-9(13)14/h5-7H,1-4H2,(H,13,14)
InChI Key:
FEDLMADKMHOMPF-UHFFFAOYSA-N
EC Number:
262-389-5
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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