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13930-67-1 | 1H-Pyrrolo[3,4-b]quinoxaline (8CI,9CI)
CAS No: 13930-67-1 Catalog No: AG001APQ MDL No:
Product Description
Catalog Number:
AG001APQ
Chemical Name:
1H-Pyrrolo[3,4-b]quinoxaline (8CI,9CI)
CAS Number:
13930-67-1
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
IUPAC Name:
1H-pyrrolo[3,4-b]quinoxaline
InChI:
InChI=1S/C10H7N3/c1-2-4-8-7(3-1)12-9-5-11-6-10(9)13-8/h1-5H,6H2
InChI Key:
CJOYNCNSOQNQIX-UHFFFAOYSA-N
SMILES:
N1=Cc2c(C1)nc1c(n2)cccc1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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