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20420-52-4 | Cyclobuta[b]quinoxaline-1,2-dione, 3,8-dihydro-
CAS No: 20420-52-4 Catalog No: AG0029CR MDL No:
Product Description
Catalog Number:
AG0029CR
Chemical Name:
Cyclobuta[b]quinoxaline-1,2-dione, 3,8-dihydro-
CAS Number:
20420-52-4
Molecular Formula:
C10H6N2O2
Molecular Weight:
186.1668
IUPAC Name:
cyclobuta[b]quinoxaline-1,2-diol
InChI:
InChI=1S/C10H6N2O2/c13-9-7-8(10(9)14)12-6-4-2-1-3-5(6)11-7/h1-4,13-14H
InChI Key:
KQYCKLYTVAUTRI-UHFFFAOYSA-N
SMILES:
O=c1c(=O)c2c1[nH]c1c([nH]2)cccc1
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.17g/mol
Monoisotopic Mass:
186.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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