3-(cyclopropylmethylsulfanyl)oxolane

C8H14OS — CID 130651983

IUPAC3-(cyclopropylmethylsulfanyl)oxolane
SMILESC1CC(SCC2CC2)CO1
InChIInChI=1S/C8H14OS/c1-2-7(1)6-10-8-3-4-9-5-8/h7-8H,1-6H2
InChIKeyPUXPYZFLOSTQTQ-UHFFFAOYSA-N
MW158.27 g/mol
LogP1.92
Rot. Bonds3

About 3-(cyclopropylmethylsulfanyl)oxolane

3-(cyclopropylmethylsulfanyl)oxolane (PubChem CID 130651983) has the molecular formula C8H14OS and a molecular weight of 158.27 g/mol. Its IUPAC name is 3-(cyclopropylmethylsulfanyl)oxolane.

Molecular Properties

Compound Name3-(cyclopropylmethylsulfanyl)oxolane
PubChem CID130651983
Molecular FormulaC8H14OS
Molecular Weight158.27 g/mol
Exact Mass158.08
IUPAC Name3-(cyclopropylmethylsulfanyl)oxolane
SMILESC1CC(SCC2CC2)CO1
InChIInChI=1S/C8H14OS/c1-2-7(1)6-10-8-3-4-9-5-8/h7-8H,1-6H2
InChIKeyPUXPYZFLOSTQTQ-UHFFFAOYSA-N
XLogP1.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.27
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(cyclohexylsulfanylmethyl)oxolane
CID 127013309
3-(2-methoxyethylsulfanyl)oxolane
CID 126989960
3-(3-methylbut-2-enylsulfanyl)oxolane
CID 126994807
3-(ethylsulfanylmethyl)oxolane
CID 130928771
1-(oxan-3-ylsulfanyl)propan-2-amine
CID 107134973
3-(bromomethyl)oxolane
CID 14173422
3-ethyloxolane
CID 10996972
dichloromethane;(3R)-3-iodooxolane
CID 158826535
4-(propan-2-ylsulfanylmethyl)oxane
CID 130725735
2-(oxolan-3-ylsulfanyl)butanoic acid
CID 105352660
3-pent-3-ynylsulfanyloxane
CID 130683815
2-(cyclopentylmethylsulfanyl)-1-(oxolan-3-yl)ethanamine
CID 104755775

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethylsulfanyl)oxolane?
The IUPAC name of 3-(cyclopropylmethylsulfanyl)oxolane (CID 130651983) is 3-(cyclopropylmethylsulfanyl)oxolane.
What is the SMILES notation for 3-(cyclopropylmethylsulfanyl)oxolane?
The canonical SMILES for 3-(cyclopropylmethylsulfanyl)oxolane is C1CC(SCC2CC2)CO1.
What is the InChIKey of 3-(cyclopropylmethylsulfanyl)oxolane?
The InChIKey is PUXPYZFLOSTQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14OS/c1-2-7(1)6-10-8-3-4-9-5-8/h7-8H,1-6H2.
What are the key properties of 3-(cyclopropylmethylsulfanyl)oxolane?
3-(cyclopropylmethylsulfanyl)oxolane has a molecular weight of 158.27 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethylsulfanyl)oxolane is sourced from PubChem (CID 130651983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).