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88281-91-8 | 1,2,4-Triazine, 3-azido-5,6-diphenyl-
CAS No: 88281-91-8 Catalog No: AG004A9D MDL No:
Product Description
Catalog Number:
AG004A9D
Chemical Name:
1,2,4-Triazine, 3-azido-5,6-diphenyl-
CAS Number:
88281-91-8
Molecular Formula:
C15H10N6
Molecular Weight:
274.2801
IUPAC Name:
3-azido-5,6-diphenyl-1,2,4-triazine
InChI:
InChI=1S/C15H10N6/c16-21-20-15-17-13(11-7-3-1-4-8-11)14(18-19-15)12-9-5-2-6-10-12/h1-10H
InChI Key:
XQSYSTZYHDEJQJ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1nnc(c(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.097g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.287g/mol
Monoisotopic Mass:
274.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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