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Home > Imidazoles > 176721-02-1
176721-02-1 | Methanone, (2,3-dimethylphenyl)[1-(triphenylmethyl)-1H-imidazol-4-yl]-
CAS No: 176721-02-1 Catalog No: AG0024UV MDL No:MFCD23135355
Product Description
Catalog Number:
AG0024UV
Chemical Name:
Methanone, (2,3-dimethylphenyl)[1-(triphenylmethyl)-1H-imidazol-4-yl]-
CAS Number:
176721-02-1
Molecular Formula:
C31H26N2O
Molecular Weight:
442.5509
MDL Number:
MFCD23135355
IUPAC Name:
(2,3-dimethylphenyl)-(3-tritylimidazol-4-yl)methanone
InChI:
InChI=1S/C31H26N2O/c1-23-13-12-20-28(24(23)2)30(34)29-21-32-22-33(29)31(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-22H,1-2H3
InChI Key:
WPSPNQNZPWTZLN-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1C)C)c1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
613
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.205g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
442.562g/mol
Monoisotopic Mass:
442.205g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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