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Home > Imidazoles > 68887-71-8
68887-71-8 | 1H-Imidazole-1-undecanoic acid
CAS No: 68887-71-8 Catalog No: AG005NNW MDL No:
Product Description
Catalog Number:
AG005NNW
Chemical Name:
1H-Imidazole-1-undecanoic acid
CAS Number:
68887-71-8
Molecular Formula:
C14H24N2O2
Molecular Weight:
252.3526
IUPAC Name:
11-imidazol-1-ylundecanoic acid
InChI:
InChI=1S/C14H24N2O2/c17-14(18)9-7-5-3-1-2-4-6-8-11-16-12-10-15-13-16/h10,12-13H,1-9,11H2,(H,17,18)
InChI Key:
VVDHLRGFVADEBB-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCn1ccnc1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.184g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.358g/mol
Monoisotopic Mass:
252.184g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Synthesis and biodistribution of (99m)Tc-carbonyltechnetium-labeled fatty acids. | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20040601 |
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