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Home > Imidazoles > 1314969-11-3
1314969-11-3 | {3-[(1H-imidazol-4-yl)methyl]phenyl}methanol
CAS No: 1314969-11-3 Catalog No: AG01B5M6 MDL No:MFCD08668128
Product Description
Catalog Number:
AG01B5M6
Chemical Name:
{3-[(1H-imidazol-4-yl)methyl]phenyl}methanol
CAS Number:
1314969-11-3
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD08668128
IUPAC Name:
[3-(1H-imidazol-5-ylmethyl)phenyl]methanol
InChI:
InChI=1S/C11H12N2O/c14-7-10-3-1-2-9(4-10)5-11-6-12-8-13-11/h1-4,6,8,14H,5,7H2,(H,12,13)
InChI Key:
FUJDGTQLUAEAAK-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)Cc1c[nH]cn1
Properties
Complexity:
175
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:
2
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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