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114535-15-8 | Cyclopropa[3,4]cyclopenta[1,2-b]quinoxaline (9CI)
CAS No: 114535-15-8 Catalog No: AG000ENP MDL No:
Product Description
Catalog Number:
AG000ENP
Chemical Name:
Cyclopropa[3,4]cyclopenta[1,2-b]quinoxaline (9CI)
CAS Number:
114535-15-8
Molecular Formula:
C12H6N2
Molecular Weight:
178.1894
IUPAC Name:
2,9-diazatetracyclo[8.4.0.03,8.04,6]tetradeca-1(14),2,4,6,8,10,12-heptaene
InChI:
InChI=1S/C12H6N2/c1-2-4-10-9(3-1)13-11-6-7-5-8(7)12(11)14-10/h1-6H
InChI Key:
GBLMMTCRMMZFNH-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nc1c(n2)cc2c1c2
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.053g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.194g/mol
Monoisotopic Mass:
178.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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