6,7,9-trimethyldec-4-ene

C13H26 — CID 123201610

IUPAC6,7,9-trimethyldec-4-ene
SMILESCCCC=CC(C)C(C)CC(C)C
InChIInChI=1S/C13H26/c1-6-7-8-9-12(4)13(5)10-11(2)3/h8-9,11-13H,6-7,10H2,1-5H3
InChIKeyNTBIOPRTWNRMPP-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.66
Rot. Bonds6

About 6,7,9-trimethyldec-4-ene

6,7,9-trimethyldec-4-ene (PubChem CID 123201610) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is 6,7,9-trimethyldec-4-ene.

Molecular Properties

Compound Name6,7,9-trimethyldec-4-ene
PubChem CID123201610
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Name6,7,9-trimethyldec-4-ene
SMILESCCCC=CC(C)C(C)CC(C)C
InChIInChI=1S/C13H26/c1-6-7-8-9-12(4)13(5)10-11(2)3/h8-9,11-13H,6-7,10H2,1-5H3
InChIKeyNTBIOPRTWNRMPP-UHFFFAOYSA-N
XLogP4.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.66
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

(E)-2,3-dimethyloct-4-ene
CID 173368392
3,4-dimethylnona-1,5-diene
CID 57098033
(6R)-6-methylnon-4-ene
CID 175484589
4,5-dimethylicos-6-ene
CID 72645531
(E)-5,6-dimethylhexadec-7-ene
CID 173368393
4-methylnon-5-en-2-ol
CID 90726696
(3S,4S)-3-methylnon-5-en-4-amine
CID 57021355
(E,2S)-2-methylhept-3-enal
CID 124565519
3-methylocta-1,4-diene
CID 123442447
(2Z,5Z)-4-methylnona-2,5-diene
CID 144517565
dimethyl 2-[(E)-hept-3-en-2-yl]propanedioate
CID 134981164
4-ethyl-2-methyldec-5-ene
CID 123185566

Frequently Asked Questions

What is the IUPAC name of 6,7,9-trimethyldec-4-ene?
The IUPAC name of 6,7,9-trimethyldec-4-ene (CID 123201610) is 6,7,9-trimethyldec-4-ene.
What is the SMILES notation for 6,7,9-trimethyldec-4-ene?
The canonical SMILES for 6,7,9-trimethyldec-4-ene is CCCC=CC(C)C(C)CC(C)C.
What is the InChIKey of 6,7,9-trimethyldec-4-ene?
The InChIKey is NTBIOPRTWNRMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26/c1-6-7-8-9-12(4)13(5)10-11(2)3/h8-9,11-13H,6-7,10H2,1-5H3.
What are the key properties of 6,7,9-trimethyldec-4-ene?
6,7,9-trimethyldec-4-ene has a molecular weight of 182.35 g/mol, XLogP of 4.66, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,9-trimethyldec-4-ene is sourced from PubChem (CID 123201610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).