CAS 35309-86-5 Thiophene, tetrahydro-3-(2-propenyloxy)-, 1,1-dioxide (HCID 2801708)

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Basic information

CAS: 35309-86-5
Standard SMILES: C=CCOC1CCS(=O)(=O)C1
InChIKey: CPYGYTPZLDSIKS-UHFFFAOYSA-N
Molecular formula: C7H12O3S
Average molar mass: 176.24 g/mol
Monoisotopic mass: 176.05071524

Overview

See also: 3-Allyloxytetrahydrothiophene 1,1-dioxide (annotation moved to).

Names & identifiers

Preferred name: Thiophene, tetrahydro-3-(2-propenyloxy)-, 1,1-dioxide
IUPAC: 3-prop-2-enoxythiolane 1,1-dioxide
English name: 3-(Allyloxy)tetrahydro-1H-1lambda6-thiophene-1,1-dione
Molecular formula: C7H12O3S
Molecular weight: 176.23

Names & synonyms

35309-86-53-prop-2-enoxythiolane 1,1-dioxide3-(Allyloxy)tetrahydrothiophene 1,1-dioxideThiophene, tetrahydro-3-(2-propenyloxy)-, 1,1-dioxide3-(ALLYLOXY)TETRAHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE1,1-dioxidotetrahydrothiophen-3-yl prop-2-en-1-yl ether3-allyloxysulfolaneSCHEMBL11013863-allyloxythiolane 1,1-dioxideDTXSID20384314MFCD00087476STL454439

Show more names

IFLAB-BB F1294-0149Thiophene, tetrahydro-3-(2-propen-1-yloxy)-, 1,1-dioxide

3-prop-2-enyloxythiolane-1,1-dioneAKOS002274872AKOS016047391CS-0359584ST501795603-(prop-2-en-1-yloxy)-1|E?-thiolane-1,1-dione3-[(Prop-2-en-1-yl)oxy]-1lambda~6~-thiolane-1,1-dione

Database identifiers

CAS: 35309-86-5
PubChem CID: 2801708
DTXSID: DTXSID20384314

Properties

Computed structural properties

XLogP: 0.3
Topological polar surface area: 51.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 225

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H317-H302
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Hazard Codes: Xi

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
Hazard statements: H319-H317-H302
Precautionary statements: P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501