(4S)-4-ethyloct-1-ene

C10H20 — CID 129373406

IUPAC(4S)-4-ethyloct-1-ene
SMILESC=CC[C@@H](CC)CCCC
InChIInChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h5,10H,2,4,6-9H2,1,3H3/t10-/m1/s1
InChIKeyPNMREIZXHOBCMA-SNVBAGLBSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds6

About (4S)-4-ethyloct-1-ene

(4S)-4-ethyloct-1-ene (PubChem CID 129373406) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is (4S)-4-ethyloct-1-ene.

Molecular Properties

Compound Name(4S)-4-ethyloct-1-ene
PubChem CID129373406
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name(4S)-4-ethyloct-1-ene
SMILESC=CC[C@@H](CC)CCCC
InChIInChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h5,10H,2,4,6-9H2,1,3H3/t10-/m1/s1
InChIKeyPNMREIZXHOBCMA-SNVBAGLBSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-ethyloct-1-ene;hexanedioic acid
CID 175450276
4-prop-2-enylpentadec-1-ene
CID 54427529
17-prop-2-enyltetratriacontane
CID 173452630
6-ethyldec-1-en-4-amine
CID 116660443
5-prop-2-enylnonan-2-ol
CID 91603961
ethene;4-ethylhex-1-ene
CID 159399050
3-(prop-2-enoxymethyl)heptane
CID 3530837
8-ethyldodec-5-ene
CID 173018114
2-ethyl-N,N-bis(prop-2-enyl)hexan-1-amine
CID 19751114
7-butylundec-1-ene
CID 174048295
2-ethyl-N-methyl-N-prop-2-enylhexan-1-amine
CID 88673133
7-prop-2-enyldodec-4-ene
CID 173342323

Frequently Asked Questions

What is the IUPAC name of (4S)-4-ethyloct-1-ene?
The IUPAC name of (4S)-4-ethyloct-1-ene (CID 129373406) is (4S)-4-ethyloct-1-ene.
What is the SMILES notation for (4S)-4-ethyloct-1-ene?
The canonical SMILES for (4S)-4-ethyloct-1-ene is C=CC[C@@H](CC)CCCC.
What is the InChIKey of (4S)-4-ethyloct-1-ene?
The InChIKey is PNMREIZXHOBCMA-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h5,10H,2,4,6-9H2,1,3H3/t10-/m1/s1.
What are the key properties of (4S)-4-ethyloct-1-ene?
(4S)-4-ethyloct-1-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-ethyloct-1-ene is sourced from PubChem (CID 129373406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).