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88529-66-2 | 1H-Pyrazole, 3-[(aminooxy)methyl]-1-(triphenylmethyl)-
CAS No: 88529-66-2 Catalog No: AG00458O MDL No:
Product Description
Catalog Number:
AG00458O
Chemical Name:
1H-Pyrazole, 3-[(aminooxy)methyl]-1-(triphenylmethyl)-
CAS Number:
88529-66-2
Molecular Formula:
C23H21N3O
Molecular Weight:
355.4323
IUPAC Name:
O-[(1-tritylpyrazol-3-yl)methyl]hydroxylamine
InChI:
InChI=1S/C23H21N3O/c24-27-18-22-16-17-26(25-22)23(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-17H,18,24H2
InChI Key:
BKCJELYPVJNJIU-UHFFFAOYSA-N
SMILES:
NOCc1ccn(n1)C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.168g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
355.441g/mol
Monoisotopic Mass:
355.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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