1-Oxa-4-thiaspiro(4.5)decane, 9-methyl-

HCID 39384

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 43117-17-5
Standard SMILES: CC1CCC2(CSCCO2)C1
InChIKey: GAYCEMCUIGXZCW-UHFFFAOYSA-N
Molecular formula: C9H16OS
Average molar mass: 172.29 g/mol
Monoisotopic mass: 172.0921863

Names & identifiers

Preferred name: 1-Oxa-4-thiaspiro(4.5)decane, 9-methyl-
IUPAC: 3-methyl-6-oxa-9-thiaspiro[4.5]decane

Names & synonyms

1-OXA-4-THIASPIRO(4.5)DECANE, 9-METHYL-43117-17-5RefChem:10561668-Methyl-1-oxa-4-thiaspiro(4.5)decaneBRN 1305234BRN 13052109-Methyl-1-oxa-4-thiaspiro(4.5)decane1-OXA-4-THIASPIRO(4.5)DECANE, 8-METHYL-DTXSID909629062-methyl-6-oxa-9-thiaspiro[4.5]decane43117-18-6

Database identifiers

CAS: 43117-17-5、43117-18-6
PubChem CID: 39384
DTXSID: DTXSID90962906

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 34.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 148

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…