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1269225-52-6 | 1-[3-(1H-imidazol-1-yl)phenyl]ethan-1-ol
CAS No: 1269225-52-6 Catalog No: AG01BJCL MDL No:MFCD18522773
Product Description
Catalog Number:
AG01BJCL
Chemical Name:
1-[3-(1H-imidazol-1-yl)phenyl]ethan-1-ol
CAS Number:
1269225-52-6
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD18522773
IUPAC Name:
1-(3-imidazol-1-ylphenyl)ethanol
InChI:
InChI=1S/C11H12N2O/c1-9(14)10-3-2-4-11(7-10)13-6-5-12-8-13/h2-9,14H,1H3
InChI Key:
QROSBXMPMCZHDF-UHFFFAOYSA-N
SMILES:
CC(c1cccc(c1)n1cncc1)O
Properties
Complexity:
186
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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