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Home > Imidazoles > 74730-76-0
74730-76-0 | Phenol, 4-(1-ethyl-1H-imidazol-5-yl)-
CAS No: 74730-76-0 Catalog No: AG005UJD MDL No:
Product Description
Catalog Number:
AG005UJD
Chemical Name:
Phenol, 4-(1-ethyl-1H-imidazol-5-yl)-
CAS Number:
74730-76-0
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
IUPAC Name:
4-(3-ethylimidazol-4-yl)phenol
InChI:
InChI=1S/C11H12N2O/c1-2-13-8-12-7-11(13)9-3-5-10(14)6-4-9/h3-8,14H,2H2,1H3
InChI Key:
KFIYWNWBURUMKX-UHFFFAOYSA-N
SMILES:
CCn1cncc1c1ccc(cc1)O
Properties
Complexity:
178
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:
1.6
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