3-Methyl-3-(methylsulfanyl)oxolan-2-one

HCID 12349923CAS 40587-60-8
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Basic information

Standard SMILES
CSC1(C)CCOC1=O
InChIKey
PKDZFMNPTBLJHS-UHFFFAOYSA-N
Molecular formula
C6H10O2S
Average molar mass
146.21 g/mol
Monoisotopic mass
146.04015056

Names & identifiers

Preferred name
3-Methyl-3-(methylsulfanyl)oxolan-2-one
IUPAC
3-methyl-3-methylsulfanyloxolan-2-one

Names & synonyms

40587-60-83-Methyl-3-(methylsulfanyl)oxolan-2-oneDTXSID00493175RefChem:280846DTXCID70443985SCHEMBL10551676PKDZFMNPTBLJHS-UHFFFAOYSA-Nalpha-methyl-alpha-methylthio-gamma-butyrolactone

Database identifiers

CAS
40587-60-8
PubChem CID
12349923
DTXSID
DTXSID00493175

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
51.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
9

Related reactions

2 records
New reaction record

Linked notes

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