(E)-4-chloro-5-ethyloct-4-ene

C10H19Cl — CID 125476371

IUPAC(E)-4-chloro-5-ethyloct-4-ene
SMILESCCC/C(Cl)=C(/CC)CCC
InChIInChI=1S/C10H19Cl/c1-4-7-9(6-3)10(11)8-5-2/h4-8H2,1-3H3/b10-9+
InChIKeyVHTBBSNKGYTVHZ-MDZDMXLPSA-N
MW174.71 g/mol
LogP4.49
Rot. Bonds5

About (E)-4-chloro-5-ethyloct-4-ene

(E)-4-chloro-5-ethyloct-4-ene (PubChem CID 125476371) has the molecular formula C10H19Cl and a molecular weight of 174.71 g/mol. Its IUPAC name is (E)-4-chloro-5-ethyloct-4-ene.

Molecular Properties

Compound Name(E)-4-chloro-5-ethyloct-4-ene
PubChem CID125476371
Molecular FormulaC10H19Cl
Molecular Weight174.71 g/mol
Exact Mass174.12
IUPAC Name(E)-4-chloro-5-ethyloct-4-ene
SMILESCCC/C(Cl)=C(/CC)CCC
InChIInChI=1S/C10H19Cl/c1-4-7-9(6-3)10(11)8-5-2/h4-8H2,1-3H3/b10-9+
InChIKeyVHTBBSNKGYTVHZ-MDZDMXLPSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.71
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-Chloro-2-methylcyclohexene
CID 565361
3-Chloro-2-methylhept-2-ene
CID 12550096
5,6-Dichloro-5-decene
CID 85760002
(e)-6-Chloro-5-methyldec-5-ene
CID 125476651
6-Chloro-2,3,6-trimethylhept-2-ene
CID 14367912
1-Chloro-2-methylcyclopentene
CID 12611388
2-Chloro-2,3,4,5-tetraethylphosphole
CID 21976005
3-Chloro-2-methylhex-2-ene
CID 22613996
5-Chloro-2,6-dimethylhepta-1,5-diene
CID 58872599
1-Chloro-2-ethylcyclopentene
CID 68880361
1-Chloro-2-ethylcyclohexene
CID 68882917
2-Chloro-3-methylhept-2-ene
CID 85591576

Frequently Asked Questions

What is the IUPAC name of (E)-4-chloro-5-ethyloct-4-ene?
The IUPAC name of (E)-4-chloro-5-ethyloct-4-ene (CID 125476371) is (E)-4-chloro-5-ethyloct-4-ene.
What is the SMILES notation for (E)-4-chloro-5-ethyloct-4-ene?
The canonical SMILES for (E)-4-chloro-5-ethyloct-4-ene is CCC/C(Cl)=C(/CC)CCC.
What is the InChIKey of (E)-4-chloro-5-ethyloct-4-ene?
The InChIKey is VHTBBSNKGYTVHZ-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H19Cl/c1-4-7-9(6-3)10(11)8-5-2/h4-8H2,1-3H3/b10-9+.
What are the key properties of (E)-4-chloro-5-ethyloct-4-ene?
(E)-4-chloro-5-ethyloct-4-ene has a molecular weight of 174.71 g/mol, XLogP of 4.49, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-chloro-5-ethyloct-4-ene is sourced from PubChem (CID 125476371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).