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Home > Nitro Compounds > 86832-06-6
86832-06-6 | 1-{[(p-nitrobenzyl)oxy]carbonyl}-1H-benzotriazole
CAS No: 86832-06-6 Catalog No: AG01EF1B MDL No:
Product Description
Catalog Number:
AG01EF1B
Chemical Name:
1-{[(p-nitrobenzyl)oxy]carbonyl}-1H-benzotriazole
CAS Number:
86832-06-6
IUPAC Name:
(4-nitrophenyl)methyl benzotriazole-1-carboxylate
InChI:
InChI=1S/C14H10N4O4/c19-14(17-13-4-2-1-3-12(13)15-16-17)22-9-10-5-7-11(8-6-10)18(20)21/h1-8H,9H2
InChI Key:
MKIHFLQNZUDOQW-UHFFFAOYSA-N
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.07g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.258g/mol
Monoisotopic Mass:
298.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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