(E)-2,5-dimethyloct-4-ene

C10H20 — CID 173056267

IUPAC(E)-2,5-dimethyloct-4-ene
SMILESCCC/C(C)=C/CC(C)C
InChIInChI=1S/C10H20/c1-5-6-10(4)8-7-9(2)3/h8-9H,5-7H2,1-4H3/b10-8+
InChIKeyXGBWZDFWOJSJID-CSKARUKUSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds4

About (E)-2,5-dimethyloct-4-ene

(E)-2,5-dimethyloct-4-ene (PubChem CID 173056267) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is (E)-2,5-dimethyloct-4-ene.

Molecular Properties

Compound Name(E)-2,5-dimethyloct-4-ene
PubChem CID173056267
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name(E)-2,5-dimethyloct-4-ene
SMILESCCC/C(C)=C/CC(C)C
InChIInChI=1S/C10H20/c1-5-6-10(4)8-7-9(2)3/h8-9H,5-7H2,1-4H3/b10-8+
InChIKeyXGBWZDFWOJSJID-CSKARUKUSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
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

(Z)-4,7-dimethylnon-4-ene
CID 143531390
(Z)-3,6-dimethylhept-3-en-1-amine
CID 178015880
(6E,10E,14E)-2,6,10,14,17-pentamethyloctadeca-2,6,10,14-tetraene
CID 140685405
(E)-2,5,9-trimethylundec-4-ene
CID 157140245
actinium;bis(3-methylhex-2-en-1-ol)
CID 160943648
2,5,9-trimethyl-8-propyldodec-5-ene
CID 123394193
2,3,6-trimethylundec-5-ene
CID 123502967
(5E,9E)-N-tert-butyl-5,9,12-trimethyltrideca-5,9-dien-2-imine
CID 138650644
(E)-2,5,6-trimethyloct-4-ene
CID 144800486
CID 174032923
CID 174032923
(4E,8E,12E)-5,9,13,16-tetramethylheptadeca-4,8,12-triene
CID 23553717
4-methyl-7-methylidenedec-4-ene
CID 173283032

Frequently Asked Questions

What is the IUPAC name of (E)-2,5-dimethyloct-4-ene?
The IUPAC name of (E)-2,5-dimethyloct-4-ene (CID 173056267) is (E)-2,5-dimethyloct-4-ene.
What is the SMILES notation for (E)-2,5-dimethyloct-4-ene?
The canonical SMILES for (E)-2,5-dimethyloct-4-ene is CCC/C(C)=C/CC(C)C.
What is the InChIKey of (E)-2,5-dimethyloct-4-ene?
The InChIKey is XGBWZDFWOJSJID-CSKARUKUSA-N. The full InChI is InChI=1S/C10H20/c1-5-6-10(4)8-7-9(2)3/h8-9H,5-7H2,1-4H3/b10-8+.
What are the key properties of (E)-2,5-dimethyloct-4-ene?
(E)-2,5-dimethyloct-4-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,5-dimethyloct-4-ene is sourced from PubChem (CID 173056267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).