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64494-16-2 | 1,2,4-Triazine, 6-phenyl-3-(3-pyridinyl)-
CAS No: 64494-16-2 Catalog No: AG00H6V1 MDL No:
Product Description
Catalog Number:
AG00H6V1
Chemical Name:
1,2,4-Triazine, 6-phenyl-3-(3-pyridinyl)-
CAS Number:
64494-16-2
Molecular Formula:
C14H10N4
Molecular Weight:
234.2560
IUPAC Name:
6-phenyl-3-pyridin-3-yl-1,2,4-triazine
InChI:
InChI=1S/C14H10N4/c1-2-5-11(6-3-1)13-10-16-14(18-17-13)12-7-4-8-15-9-12/h1-10H
InChI Key:
VMLZWORLHGBXCM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cnc(nn1)c1cccnc1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.091g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.262g/mol
Monoisotopic Mass:
234.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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