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Home > Imidazoles > 91463-64-8
91463-64-8 | 1H-Imidazole, 1-hydroxy-2-methyl(phenylmethyl)-
CAS No: 91463-64-8 Catalog No: AG006M1Z MDL No:
Product Description
Catalog Number:
AG006M1Z
Chemical Name:
1H-Imidazole, 1-hydroxy-2-methyl(phenylmethyl)-
CAS Number:
91463-64-8
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
IUPAC Name:
4-benzyl-1-hydroxy-2-methylimidazole
InChI:
InChI=1S/C11H12N2O/c1-9-12-11(8-13(9)14)7-10-5-3-2-4-6-10/h2-6,8,14H,7H2,1H3
InChI Key:
PWNYWPGLYSKDGP-UHFFFAOYSA-N
SMILES:
On1cc(nc1C)Cc1ccccc1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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