1-pent-1-enylsulfanylpent-1-ene

C10H18S — CID 57139871

IUPAC1-pent-1-enylsulfanylpent-1-ene
SMILESCCCC=CSC=CCCC
InChIInChI=1S/C10H18S/c1-3-5-7-9-11-10-8-6-4-2/h7-10H,3-6H2,1-2H3
InChIKeyIPSJCHUKYIMNQI-UHFFFAOYSA-N
MW170.32 g/mol
LogP4.35
Rot. Bonds6

About 1-pent-1-enylsulfanylpent-1-ene

1-pent-1-enylsulfanylpent-1-ene (PubChem CID 57139871) has the molecular formula C10H18S and a molecular weight of 170.32 g/mol. Its IUPAC name is 1-pent-1-enylsulfanylpent-1-ene.

Molecular Properties

Compound Name1-pent-1-enylsulfanylpent-1-ene
PubChem CID57139871
Molecular FormulaC10H18S
Molecular Weight170.32 g/mol
Exact Mass170.11
IUPAC Name1-pent-1-enylsulfanylpent-1-ene
SMILESCCCC=CSC=CCCC
InChIInChI=1S/C10H18S/c1-3-5-7-9-11-10-8-6-4-2/h7-10H,3-6H2,1-2H3
InChIKeyIPSJCHUKYIMNQI-UHFFFAOYSA-N
XLogP4.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.32
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-pent-1-enylsulfanylpent-1-ene?
The IUPAC name of 1-pent-1-enylsulfanylpent-1-ene (CID 57139871) is 1-pent-1-enylsulfanylpent-1-ene.
What is the SMILES notation for 1-pent-1-enylsulfanylpent-1-ene?
The canonical SMILES for 1-pent-1-enylsulfanylpent-1-ene is CCCC=CSC=CCCC.
What is the InChIKey of 1-pent-1-enylsulfanylpent-1-ene?
The InChIKey is IPSJCHUKYIMNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18S/c1-3-5-7-9-11-10-8-6-4-2/h7-10H,3-6H2,1-2H3.
What are the key properties of 1-pent-1-enylsulfanylpent-1-ene?
1-pent-1-enylsulfanylpent-1-ene has a molecular weight of 170.32 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-1-enylsulfanylpent-1-ene is sourced from PubChem (CID 57139871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).