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77234-86-7 | 1H-Imidazole-1-ethanol,a-[1,1'-biphenyl]-4-yl-b-methyl-, hydrochloride (1:1)
CAS No: 77234-86-7 Catalog No: AG00553S MDL No:
Product Description
Catalog Number:
AG00553S
Chemical Name:
1H-Imidazole-1-ethanol,a-[1,1'-biphenyl]-4-yl-b-methyl-, hydrochloride (1:1)
CAS Number:
77234-86-7
Molecular Formula:
C18H19ClN2O
Molecular Weight:
314.8093
IUPAC Name:
2-imidazol-1-yl-1-(4-phenylphenyl)propan-1-ol;hydrochloride
InChI:
InChI=1S/C18H18N2O.ClH/c1-14(20-12-11-19-13-20)18(21)17-9-7-16(8-10-17)15-5-3-2-4-6-15;/h2-14,18,21H,1H3;1H
InChI Key:
CXVYHVRNSQXTQO-UHFFFAOYSA-N
SMILES:
OC(C(n1cncc1)C)c1ccc(cc1)c1ccccc1.Cl
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.119g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.813g/mol
Monoisotopic Mass:
314.119g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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