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261-63-2 | Pyrido[2,3-b]quinoxaline
CAS No: 261-63-2 Catalog No: AG002RNP MDL No:
Product Description
Catalog Number:
AG002RNP
Chemical Name:
Pyrido[2,3-b]quinoxaline
CAS Number:
261-63-2
Molecular Formula:
C11H7N3
Molecular Weight:
181.1934
IUPAC Name:
pyrido[3,2-b]quinoxaline
InChI:
InChI=1S/C11H7N3/c1-2-5-9-8(4-1)13-10-6-3-7-12-11(10)14-9/h1-7H
InChI Key:
KGJRPYISHAZCMA-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nc1c(n2)cccn1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.198g/mol
Monoisotopic Mass:
181.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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