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Home > Imidazoles > 1955530-25-2
1955530-25-2 | {2-[(1H-imidazol-4-yl)methyl]phenyl}methanol hydrochloride
CAS No: 1955530-25-2 Catalog No: AG01B2RK MDL No:MFCD29991714
Product Description
Catalog Number:
AG01B2RK
Chemical Name:
{2-[(1H-imidazol-4-yl)methyl]phenyl}methanol hydrochloride
CAS Number:
1955530-25-2
Molecular Formula:
C11H13ClN2O
Molecular Weight:
224.6867
MDL Number:
MFCD29991714
IUPAC Name:
[2-(1H-imidazol-5-ylmethyl)phenyl]methanol;hydrochloride
InChI:
InChI=1S/C11H12N2O.ClH/c14-7-10-4-2-1-3-9(10)5-11-6-12-8-13-11;/h1-4,6,8,14H,5,7H2,(H,12,13);1H
InChI Key:
UWAGUMZAXPELBT-UHFFFAOYSA-N
SMILES:
OCc1ccccc1Cc1c[nH]cn1.Cl
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
224.688g/mol
Monoisotopic Mass:
224.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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