(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene

C12H24SSe — CID 134987779

IUPAC(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene
SMILESCCCCCC/C=C(/SCC)[Se]CC
InChIInChI=1S/C12H24SSe/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h11H,4-10H2,1-3H3/b12-11-
InChIKeyLIWKOLCNUMJYDZ-QXMHVHEDSA-N
MW279.35 g/mol
LogP4.69
Rot. Bonds9

About (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene

(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene (PubChem CID 134987779) has the molecular formula C12H24SSe and a molecular weight of 279.35 g/mol. Its IUPAC name is (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene.

Molecular Properties

Compound Name(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene
PubChem CID134987779
Molecular FormulaC12H24SSe
Molecular Weight279.35 g/mol
Exact Mass280.08
IUPAC Name(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene
SMILESCCCCCC/C=C(/SCC)[Se]CC
InChIInChI=1S/C12H24SSe/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h11H,4-10H2,1-3H3/b12-11-
InChIKeyLIWKOLCNUMJYDZ-QXMHVHEDSA-N
XLogP4.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-1-methylselanyl-1-methylsulfanyloct-1-ene
CID 11276786
(Z)-1-methylselanyl-1-methylsulfanyloct-1-ene
CID 15506043
(Z)-1-ethylsulfanyl-1-methylselanyloct-1-ene
CID 15506044
1,1-Bis(ethylsulfanyl)oct-1-ene
CID 85626143
(E)-1-ethylsulfanyl-1-(2-methylpropylselanyl)oct-1-ene
CID 134919505
(E)-1-ethylsulfanyl-1-methylselanyloct-1-ene
CID 134919864
(Z)-1-ethylselanyl-1-(2-methylpropylsulfanyl)oct-1-ene
CID 134923126
(Z)-1-(2-methylpropylselanyl)-1-methylsulfanyloct-1-ene
CID 134923144
(Z)-1-ethylsulfanyl-1-(2-methylpropylselanyl)oct-1-ene
CID 134923297
(Z)-1-(2-methylpropylsulfanyl)-1-methylselanyloct-1-ene
CID 134923319
(Z)-1-ethylselanyl-1-methylsulfanyloct-1-ene
CID 134923320
(Z)-1-(2-methylpropylselanyl)-1-(2-methylpropylsulfanyl)oct-1-ene
CID 134986848

Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene?
The IUPAC name of (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene (CID 134987779) is (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene.
What is the SMILES notation for (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene?
The canonical SMILES for (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene is CCCCCC/C=C(/SCC)[Se]CC.
What is the InChIKey of (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene?
The InChIKey is LIWKOLCNUMJYDZ-QXMHVHEDSA-N. The full InChI is InChI=1S/C12H24SSe/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h11H,4-10H2,1-3H3/b12-11-.
What are the key properties of (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene?
(Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene has a molecular weight of 279.35 g/mol, XLogP of 4.69, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethylselanyl-1-ethylsulfanyloct-1-ene is sourced from PubChem (CID 134987779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).