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88529-71-9 | 1H-Pyrazole, 4-[(aminooxy)methyl]-1-(triphenylmethyl)-
CAS No: 88529-71-9 Catalog No: AG0045Q5 MDL No:
Product Description
Catalog Number:
AG0045Q5
Chemical Name:
1H-Pyrazole, 4-[(aminooxy)methyl]-1-(triphenylmethyl)-
CAS Number:
88529-71-9
Molecular Formula:
C23H21N3O
Molecular Weight:
355.4323
IUPAC Name:
O-[(1-tritylpyrazol-4-yl)methyl]hydroxylamine
InChI:
InChI=1S/C23H21N3O/c24-27-18-19-16-25-26(17-19)23(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17H,18,24H2
InChI Key:
BBISIDKAMFBQES-UHFFFAOYSA-N
SMILES:
NOCc1cnn(c1)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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