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259665-16-2 | 1H-Pyrazole, 3-(2-naphthalenyl)-1,5-diphenyl-
CAS No: 259665-16-2 Catalog No: AG002R7N MDL No:
Product Description
Catalog Number:
AG002R7N
Chemical Name:
1H-Pyrazole, 3-(2-naphthalenyl)-1,5-diphenyl-
CAS Number:
259665-16-2
Molecular Formula:
C25H18N2
Molecular Weight:
346.4238
IUPAC Name:
3-naphthalen-2-yl-1,5-diphenylpyrazole
InChI:
InChI=1S/C25H18N2/c1-3-10-20(11-4-1)25-18-24(26-27(25)23-13-5-2-6-14-23)22-16-15-19-9-7-8-12-21(19)17-22/h1-18H
InChI Key:
XTDYVMBMDXXLTD-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)n1nc(cc1c1ccccc1)c1ccc2c(c1)cccc2
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.147g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.433g/mol
Monoisotopic Mass:
346.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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