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Home > Imidazoles > 80304-50-3
80304-50-3 | 1-Benzyl-5-hydroxymethyl-1H-imidazole
CAS No: 80304-50-3 Catalog No: AG005BR7 MDL No:MFCD02179524
Product Description
Catalog Number:
AG005BR7
Chemical Name:
1-Benzyl-5-hydroxymethyl-1H-imidazole
CAS Number:
80304-50-3
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD02179524
IUPAC Name:
(3-benzylimidazol-4-yl)methanol
InChI:
InChI=1S/C11H12N2O/c14-8-11-6-12-9-13(11)7-10-4-2-1-3-5-10/h1-6,9,14H,7-8H2
InChI Key:
GQZILHANXWXTIW-UHFFFAOYSA-N
SMILES:
OCc1cncn1Cc1ccccc1
Properties
Complexity:
169
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:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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