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84255-22-1 | 1H-Imidazole-5-carboxylicacid, 2-undecyl-
CAS No: 84255-22-1 Catalog No: AG004YQ6 MDL No:
Product Description
Catalog Number:
AG004YQ6
Chemical Name:
1H-Imidazole-5-carboxylicacid, 2-undecyl-
CAS Number:
84255-22-1
Molecular Formula:
C15H26N2O2
Molecular Weight:
266.3791
IUPAC Name:
2-undecyl-1H-imidazole-5-carboxylic acid
InChI:
InChI=1S/C15H26N2O2/c1-2-3-4-5-6-7-8-9-10-11-14-16-12-13(17-14)15(18)19/h12H,2-11H2,1H3,(H,16,17)(H,18,19)
InChI Key:
DIDXGZDIJOYLCZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCc1ncc([nH]1)C(=O)O
EC Number:
282-569-7
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.199g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.385g/mol
Monoisotopic Mass:
266.199g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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