2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl chloride
Basic information
- CAS
477587-17-0- Standard SMILES
O=C(Cl)c1scc2c1OCCO2- InChIKey
ZHPVCHMDVVGUMV-UHFFFAOYSA-N- Molecular formula
- C7H5ClO3S
- Average molar mass
- 204.63 g/mol
- Monoisotopic mass
- 203.9647929
Names & identifiers
- Preferred name
- 2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl chloride
- IUPAC
- 2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbonyl chloride
- English name
- 2,3-DIHYDROTHIENO[3,4-B][1,4]DIOXIN-5-CARBONYL CHLORIDE
- Molecular formula
- C7H5ClO3S
- Molecular weight
- 204.63
Names & synonyms
477587-17-02,3-Dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl chloride2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbonyl chlorideThieno[3,4-b]-1,4-dioxin-5-carbonylchloride, 2,3-dihydro-SCHEMBL41930297DTXSID60428781Thieno[3,4-b]-1,4-dioxin-5-carbonylchloride,2,3-dihydro-Thieno[3,4-b]-1,4-dioxin-5-carbonyl chloride, 2,3-dihydro-2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl chloride 90%Thieno[3,4-b]-1,4-dioxin-5-carbonyl chloride, 2,3-dihydro- (9CI)
Database identifiers
- CAS
477587-17-0- PubChem CID
- 7537656
- DTXSID
DTXSID60428781- Nikkaji
- J1.838.951G
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Melting point
- 75 °C · 75 °C
- HS Code
- 2934999090 · 2934999090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934999090
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Related reactions
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Compound notes
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