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16492-63-0 | 1H-Pyrazole-5-methanol, 1,3-diphenyl-
CAS No: 16492-63-0 Catalog No: AG001V66 MDL No:
Product Description
Catalog Number:
AG001V66
Chemical Name:
1H-Pyrazole-5-methanol, 1,3-diphenyl-
CAS Number:
16492-63-0
Molecular Formula:
C16H14N2O
Molecular Weight:
250.2952
IUPAC Name:
(2,5-diphenylpyrazol-3-yl)methanol
InChI:
InChI=1S/C16H14N2O/c19-12-15-11-16(13-7-3-1-4-8-13)17-18(15)14-9-5-2-6-10-14/h1-11,19H,12H2
InChI Key:
XOUHWULVDNZGAI-UHFFFAOYSA-N
SMILES:
OCc1cc(nn1c1ccccc1)c1ccccc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.301g/mol
Monoisotopic Mass:
250.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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