(Z)-icos-2-ene

C20H40 — CID 5352524

IUPAC(Z)-icos-2-ene
SMILESC/C=C\CCCCCCCCCCCCCCCCC
InChIInChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5H,4,6-20H2,1-2H3/b5-3-
InChIKeyVHMBMZSDFOQAHR-HYXAFXHYSA-N
MW280.54 g/mol
LogP7.82
Rot. Bonds16

About (Z)-icos-2-ene

(Z)-icos-2-ene (PubChem CID 5352524) has the molecular formula C20H40 and a molecular weight of 280.54 g/mol. Its IUPAC name is (Z)-icos-2-ene.

Molecular Properties

Compound Name(Z)-icos-2-ene
PubChem CID5352524
Molecular FormulaC20H40
Molecular Weight280.54 g/mol
Exact Mass280.31
IUPAC Name(Z)-icos-2-ene
SMILESC/C=C\CCCCCCCCCCCCCCCCC
InChIInChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5H,4,6-20H2,1-2H3/b5-3-
InChIKeyVHMBMZSDFOQAHR-HYXAFXHYSA-N
XLogP7.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.54
LogP ≤ 57.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

octadeca-2,10-diene
CID 54270716
(2E,8Z)-pentadeca-2,8-diene
CID 173032001
(Z)-oct-2-ene
CID 5356796
pentadeca-2,6-diene
CID 165019979
sodium;hydride;octadec-2-ene
CID 175594563
oct-2-ene;hydrochloride
CID 86744102
pentadeca-2,10-diene
CID 174048350
(2Z,6E)-dodeca-2,6-diene;palladium
CID 158734810
(Z)-dodec-2-ene;propan-2-one
CID 175013676
hexane;(Z)-hex-2-ene
CID 159343029
formic acid;oct-2-ene
CID 159391664
(24Z)-hexatriaconta-9,24-diene
CID 173127472

Frequently Asked Questions

What is the IUPAC name of (Z)-icos-2-ene?
The IUPAC name of (Z)-icos-2-ene (CID 5352524) is (Z)-icos-2-ene.
What is the SMILES notation for (Z)-icos-2-ene?
The canonical SMILES for (Z)-icos-2-ene is C/C=C\CCCCCCCCCCCCCCCCC.
What is the InChIKey of (Z)-icos-2-ene?
The InChIKey is VHMBMZSDFOQAHR-HYXAFXHYSA-N. The full InChI is InChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5H,4,6-20H2,1-2H3/b5-3-.
What are the key properties of (Z)-icos-2-ene?
(Z)-icos-2-ene has a molecular weight of 280.54 g/mol, XLogP of 7.82, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-icos-2-ene is sourced from PubChem (CID 5352524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).