6b,8a-Dihydro-6b,8a-dimethyl(1,2)dioxeto(3',4':4,5)furo(3,2-h)quinoline

HCID 154334

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Basic information

CAS: 129812-30-2
Standard SMILES: CC12OOC1(C)c1ccc3cccnc3c1O2
InChIKey: KRMGRLDDZCFISE-UHFFFAOYSA-N
Molecular formula: C13H11NO3
Average molar mass: 229.23 g/mol
Monoisotopic mass: 229.07389321

Names & identifiers

Preferred name: 6b,8a-Dihydro-6b,8a-dimethyl(1,2)dioxeto(3',4':4,5)furo(3,2-h)quinoline
IUPAC: 11,14-dimethyl-12,13,15-trioxa-3-azatetracyclo[8.5.0.02,7.011,14]pentadeca-1(10),2(7),3,5,8-pentaene

Names & synonyms

129812-30-26b,8a-Dihydro-6b,8a-dimethyl(1,2)dioxeto(3',4':4,5)furo(3,2-h)quinolineCCRIS 41676B,8A-DIHYDRO-6B,8A-DIMETHYL[1,2]DIOXETO[3',4':4,5]FURO[3,2-H]QUINOLINEDTXSID309265076b,8a-Dimethyl-6b,8a-dihydro[1,2]dioxeto[3',4':4,5]furo[3,2-h]quinoline

Database identifiers

CAS: 129812-30-2
PubChem CID: 154334
DTXSID: DTXSID30926507

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 40.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 0
Heavy atoms: 17
Formal charge: 0
Complexity: 350

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