2-ethylsulfanyl-1-methylsulfanylpropane

C6H14S2 — CID 86127985

IUPAC2-ethylsulfanyl-1-methylsulfanylpropane
SMILESCCSC(C)CSC
InChIInChI=1S/C6H14S2/c1-4-8-6(2)5-7-3/h6H,4-5H2,1-3H3
InChIKeyVIQXHOAGRAKPOE-UHFFFAOYSA-N
MW150.31 g/mol
LogP2.49
Rot. Bonds4

About 2-ethylsulfanyl-1-methylsulfanylpropane

2-ethylsulfanyl-1-methylsulfanylpropane (PubChem CID 86127985) has the molecular formula C6H14S2 and a molecular weight of 150.31 g/mol. Its IUPAC name is 2-ethylsulfanyl-1-methylsulfanylpropane.

Molecular Properties

Compound Name2-ethylsulfanyl-1-methylsulfanylpropane
PubChem CID86127985
Molecular FormulaC6H14S2
Molecular Weight150.31 g/mol
Exact Mass150.05
IUPAC Name2-ethylsulfanyl-1-methylsulfanylpropane
SMILESCCSC(C)CSC
InChIInChI=1S/C6H14S2/c1-4-8-6(2)5-7-3/h6H,4-5H2,1-3H3
InChIKeyVIQXHOAGRAKPOE-UHFFFAOYSA-N
XLogP2.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.31
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethylsulfanylbutane
CID 521270
2-ethylsulfanyl-N,N-dimethylpropan-1-amine
CID 123426683
2-ethylsulfanyl-1-methoxypropane
CID 126992573
1-(2-ethylsulfanylpropylsulfanyl)-4-methylbenzene
CID 146406080
N-[(2S)-2-ethylsulfanylpropyl]methanimine
CID 142816780
5-ethylsulfanylhexan-1-amine
CID 138478357
1-ethylsulfanylpropane-1,2-diol
CID 87617073
4-(methylsulfanylmethyl)octane
CID 154986903
1,2-bis(ethylsulfanyl)-1-methylsulfanylethane
CID 167045986
3-ethylsulfanylbutanehydrazide
CID 63582860
[ethylsulfanyl(fluoro)methyl]sulfanylethane
CID 139914135
bis(ethylsulfanyl)methanol
CID 175288915

Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfanyl-1-methylsulfanylpropane?
The IUPAC name of 2-ethylsulfanyl-1-methylsulfanylpropane (CID 86127985) is 2-ethylsulfanyl-1-methylsulfanylpropane.
What is the SMILES notation for 2-ethylsulfanyl-1-methylsulfanylpropane?
The canonical SMILES for 2-ethylsulfanyl-1-methylsulfanylpropane is CCSC(C)CSC.
What is the InChIKey of 2-ethylsulfanyl-1-methylsulfanylpropane?
The InChIKey is VIQXHOAGRAKPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14S2/c1-4-8-6(2)5-7-3/h6H,4-5H2,1-3H3.
What are the key properties of 2-ethylsulfanyl-1-methylsulfanylpropane?
2-ethylsulfanyl-1-methylsulfanylpropane has a molecular weight of 150.31 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfanyl-1-methylsulfanylpropane is sourced from PubChem (CID 86127985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).