(Z)-1-ethenylsulfanyl-4-methyloct-1-ene

C11H20S — CID 167200052

IUPAC(Z)-1-ethenylsulfanyl-4-methyloct-1-ene
SMILESC=CS/C=C\CC(C)CCCC
InChIInChI=1S/C11H20S/c1-4-6-8-11(3)9-7-10-12-5-2/h5,7,10-11H,2,4,6,8-9H2,1,3H3/b10-7-
InChIKeyRVZNBTZGRBSMBV-YFHOEESVSA-N
MW184.35 g/mol
LogP4.59
Rot. Bonds7

About (Z)-1-ethenylsulfanyl-4-methyloct-1-ene

(Z)-1-ethenylsulfanyl-4-methyloct-1-ene (PubChem CID 167200052) has the molecular formula C11H20S and a molecular weight of 184.35 g/mol. Its IUPAC name is (Z)-1-ethenylsulfanyl-4-methyloct-1-ene.

Molecular Properties

Compound Name(Z)-1-ethenylsulfanyl-4-methyloct-1-ene
PubChem CID167200052
Molecular FormulaC11H20S
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name(Z)-1-ethenylsulfanyl-4-methyloct-1-ene
SMILESC=CS/C=C\CC(C)CCCC
InChIInChI=1S/C11H20S/c1-4-6-8-11(3)9-7-10-12-5-2/h5,7,10-11H,2,4,6,8-9H2,1,3H3/b10-7-
InChIKeyRVZNBTZGRBSMBV-YFHOEESVSA-N
XLogP4.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(E)-2-methylsulfanylethenyl]cyclohexane
CID 134986023
(3S,4S,5S)-3,4-dimethyl-5-methylsulfanylnon-1-ene
CID 10910550
2-Butyl-4-pentenethiol
CID 129783071
[(Z)-2-methylsulfanylethenyl]cyclohexane
CID 134933564
(4S,5S)-4-methyl-5-methylsulfanylhex-1-ene
CID 134980226
(4S,5S)-4-methyl-5-methylsulfanylnon-1-ene
CID 135060143
1,3-bis[(E)-2-methylsulfanylethenyl]cyclopentane
CID 138985190
1-ethenyl-3-[(E)-2-methylsulfanylethenyl]cyclopentane
CID 138985191
3-Ethenyloctane-1-thiol
CID 12400865
(E)-1-methylsulfanyl-oct-1-ene
CID 12514287
2,4,6-Trimethyloct-7-ene-1-thiol
CID 20298660
3,4-Bis(ethenyl)hexane-2,5-dithiol
CID 20581910

Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethenylsulfanyl-4-methyloct-1-ene?
The IUPAC name of (Z)-1-ethenylsulfanyl-4-methyloct-1-ene (CID 167200052) is (Z)-1-ethenylsulfanyl-4-methyloct-1-ene.
What is the SMILES notation for (Z)-1-ethenylsulfanyl-4-methyloct-1-ene?
The canonical SMILES for (Z)-1-ethenylsulfanyl-4-methyloct-1-ene is C=CS/C=C\CC(C)CCCC.
What is the InChIKey of (Z)-1-ethenylsulfanyl-4-methyloct-1-ene?
The InChIKey is RVZNBTZGRBSMBV-YFHOEESVSA-N. The full InChI is InChI=1S/C11H20S/c1-4-6-8-11(3)9-7-10-12-5-2/h5,7,10-11H,2,4,6,8-9H2,1,3H3/b10-7-.
What are the key properties of (Z)-1-ethenylsulfanyl-4-methyloct-1-ene?
(Z)-1-ethenylsulfanyl-4-methyloct-1-ene has a molecular weight of 184.35 g/mol, XLogP of 4.59, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethenylsulfanyl-4-methyloct-1-ene is sourced from PubChem (CID 167200052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).