Furo(2,3-f)-1,4-benzodioxin-8-carboxylic acid, 7-methyl-, dimethylaminoethyl ester, hydrochloride

HCID 215546

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Basic information

CAS: 35839-95-3
Standard SMILES: Cc1c(C(=O)OCCN(C)C)oc2c3c(ccc12)OCCO3.Cl
InChIKey: DRNVRFSMSPWNQF-UHFFFAOYSA-N
Molecular formula: C16H20ClNO5
Average molar mass: 341.78 g/mol
Monoisotopic mass: 341.1030004

Names & identifiers

Preferred name: Furo(2,3-f)-1,4-benzodioxin-8-carboxylic acid, 7-methyl-, dimethylaminoethyl ester, hydrochloride
IUPAC: 2-(dimethylamino)ethyl 7-methyl-2,3-dihydrofuro[3,2-h][1,4]benzodioxine-8-carboxylate;hydrochloride

Names & synonyms

35839-95-3Furo(2,3-f)-1,4-benzodioxin-8-carboxylic acid, 7-methyl-, dimethylaminoethyl ester, hydrochlorideDTXSID30189372RefChem:345910DTXCID601118632-(dimethylamino)ethyl 7-methyl-2,3-dihydrofuro[3,2-h][1,4]benzodioxine-8-carboxylate;hydrochlorideSR-01000195483SR-01000195483-12-(Dimethylamino)ethyl 7-methyl-2,3-dihydrofuro[2,3-f][1,4]benzodioxine-8-carboxylate--hydrogen chloride (1/1)

Database identifiers

CAS: 35839-95-3
PubChem CID: 215546
DTXSID: DTXSID30189372

Properties

Computed structural properties

Topological polar surface area: 61.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 23
Formal charge: 0
Complexity: 402

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