(E)-3-methyldec-4-ene

C11H22 — CID 5364642

IUPAC(E)-3-methyldec-4-ene
SMILESCCCCC/C=C/C(C)CC
InChIInChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h9-11H,4-8H2,1-3H3/b10-9+
InChIKeyCIFRDUBVGCEDOT-MDZDMXLPSA-N
MW154.30 g/mol
LogP4.17
Rot. Bonds6

About (E)-3-methyldec-4-ene

(E)-3-methyldec-4-ene (PubChem CID 5364642) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is (E)-3-methyldec-4-ene.

Molecular Properties

Compound Name(E)-3-methyldec-4-ene
PubChem CID5364642
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name(E)-3-methyldec-4-ene
SMILESCCCCC/C=C/C(C)CC
InChIInChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h9-11H,4-8H2,1-3H3/b10-9+
InChIKeyCIFRDUBVGCEDOT-MDZDMXLPSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.17
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

3-methyltetradec-4-ene
CID 123180851
(E)-3-methylnon-4-ene
CID 13082837
5-methyldodec-6-ene
CID 86165480
5-methylpentadec-6-ene
CID 123440014
(E,11S)-11-methyltricos-9-ene
CID 163215390
(E)-10-methylheptadec-8-ene
CID 10923034
N,7-dimethylnon-5-en-1-amine
CID 166916633
7-methylhexadec-5-ene
CID 150059561
tetrakis[(E)-hept-1-enyl]phosphanium
CID 118306753
(E)-3-methylundec-4-en-1-ol
CID 121006781
(E)-2-bromonon-3-ene
CID 88753535
(Z,2R)-non-3-en-2-ol
CID 11040800

Frequently Asked Questions

What is the IUPAC name of (E)-3-methyldec-4-ene?
The IUPAC name of (E)-3-methyldec-4-ene (CID 5364642) is (E)-3-methyldec-4-ene.
What is the SMILES notation for (E)-3-methyldec-4-ene?
The canonical SMILES for (E)-3-methyldec-4-ene is CCCCC/C=C/C(C)CC.
What is the InChIKey of (E)-3-methyldec-4-ene?
The InChIKey is CIFRDUBVGCEDOT-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h9-11H,4-8H2,1-3H3/b10-9+.
What are the key properties of (E)-3-methyldec-4-ene?
(E)-3-methyldec-4-ene has a molecular weight of 154.30 g/mol, XLogP of 4.17, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-methyldec-4-ene is sourced from PubChem (CID 5364642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).