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249-06-9 | 5H-Benz[g]indolo[2,3-b]quinoxaline
CAS No: 249-06-9 Catalog No: AG002PSN MDL No:
Product Description
Catalog Number:
AG002PSN
Chemical Name:
5H-Benz[g]indolo[2,3-b]quinoxaline
CAS Number:
249-06-9
Molecular Formula:
C18H11N3
Molecular Weight:
269.3000
IUPAC Name:
2,10,12-triazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
InChI:
InChI=1S/C18H11N3/c1-2-6-12-10-16-15(9-11(12)5-1)19-17-13-7-3-4-8-14(13)20-18(17)21-16/h1-10H,(H,20,21)
InChI Key:
QJTQJHWPLZIMPE-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc1c(c2)nc2c(n1)c1ccccc1[nH]2
NSC Number:
111854
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.307g/mol
Monoisotopic Mass:
269.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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