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Home > Imidazoles > 176721-03-2
176721-03-2 | 1H-Imidazole-4-methanol, α-(2,3-dimethylphenyl)-α-methyl-1-(triphenylmethyl)-
CAS No: 176721-03-2 Catalog No: AG0024UU MDL No:MFCD23135356
Product Description
Catalog Number:
AG0024UU
Chemical Name:
1H-Imidazole-4-methanol, α-(2,3-dimethylphenyl)-α-methyl-1-(triphenylmethyl)-
CAS Number:
176721-03-2
Molecular Formula:
C32H30N2O
Molecular Weight:
458.5934
MDL Number:
MFCD23135356
IUPAC Name:
1-(2,3-dimethylphenyl)-1-(3-tritylimidazol-4-yl)ethanol
InChI:
InChI=1S/C32H30N2O/c1-24-14-13-21-29(25(24)2)31(3,35)30-22-33-23-34(30)32(26-15-7-4-8-16-26,27-17-9-5-10-18-27)28-19-11-6-12-20-28/h4-23,35H,1-3H3
InChI Key:
JDQAHNCWMFJBCD-UHFFFAOYSA-N
SMILES:
Cc1c(C)cccc1C(c1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)(O)C
Properties
Complexity:
617
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
458.236g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
458.605g/mol
Monoisotopic Mass:
458.236g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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