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88405-51-0 | Benzaldehyde, 4-(4,5-dihydro-3,5,5-triphenyl-1H-pyrazol-1-yl)-, oxime
CAS No: 88405-51-0 Catalog No: AG008D1T MDL No:
Product Description
Catalog Number:
AG008D1T
Chemical Name:
Benzaldehyde, 4-(4,5-dihydro-3,5,5-triphenyl-1H-pyrazol-1-yl)-, oxime
CAS Number:
88405-51-0
Molecular Formula:
C28H23N3O
Molecular Weight:
417.5017
IUPAC Name:
N-[[4-(3,5,5-triphenyl-4H-pyrazol-1-yl)phenyl]methylidene]hydroxylamine
InChI:
InChI=1S/C28H23N3O/c32-29-21-22-16-18-26(19-17-22)31-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)20-27(30-31)23-10-4-1-5-11-23/h1-19,21,32H,20H2
InChI Key:
GUOHTKATIWDVFF-UHFFFAOYSA-N
SMILES:
ON=Cc1ccc(cc1)N1N=C(CC1(c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.184g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
417.512g/mol
Monoisotopic Mass:
417.184g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.2
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