cis-3a,8a-Dihydro-4,6-dimethoxyfuro(2,3-b)benzofuran

HCID 154458

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Basic information

CAS: 135105-89-4
Standard SMILES: COc1cc(OC)c2c(c1)O[C@@H]1OC=C[C@H]21
InChIKey: KEFXQTPQVMBKRL-PELKAZGASA-N
Molecular formula: C12H12O4
Average molar mass: 220.22 g/mol
Monoisotopic mass: 220.07355886

Names & identifiers

Preferred name: cis-3a,8a-Dihydro-4,6-dimethoxyfuro(2,3-b)benzofuran
IUPAC: (3aS,8bR)-6,8-dimethoxy-3a,8b-dihydrofuro[2,3-b][1]benzofuran

Names & synonyms

135105-89-4cis-3a,8a-Dihydro-4,6-dimethoxyfuro(2,3-b)benzofuran(3aS,8bR)-6,8-dimethoxy-3a,8b-dihydrofuro[2,3-b][1]benzofuranCCRIS 5353VGA7495FRGCIS-3A,8A-DIHYDRO-4,6-DIMETHOXYFURO[2,3-B]BENZOFURANUNII-VGA7495FRG3a,8a-Dihydro-4,6-dimethoxyfuro(2,3-b)benzofuran, cis-DTXSID30159257(3aR,8aS)-4,6-Dimethoxy-3a,8a-dihydrofuro[2,3-b][1]benzofuran

Database identifiers

CAS: 135105-89-4
PubChem CID: 154458
DTXSID: DTXSID30159257

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 36.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 291

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