3,4,8-trimethylnon-3-ene

C12H24 — CID 123973517

IUPAC3,4,8-trimethylnon-3-ene
SMILESCCC(C)=C(C)CCCC(C)C
InChIInChI=1S/C12H24/c1-6-11(4)12(5)9-7-8-10(2)3/h10H,6-9H2,1-5H3
InChIKeyUVXGFXYKFKSOPZ-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds5

About 3,4,8-trimethylnon-3-ene

3,4,8-trimethylnon-3-ene (PubChem CID 123973517) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 3,4,8-trimethylnon-3-ene.

Molecular Properties

Compound Name3,4,8-trimethylnon-3-ene
PubChem CID123973517
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name3,4,8-trimethylnon-3-ene
SMILESCCC(C)=C(C)CCCC(C)C
InChIInChI=1S/C12H24/c1-6-11(4)12(5)9-7-8-10(2)3/h10H,6-9H2,1-5H3
InChIKeyUVXGFXYKFKSOPZ-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.56
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)-3,4-dimethylicos-3-ene
CID 173263978
ethane;7-methyloctan-3-one
CID 142816942
(E)-4,8-dimethylnon-3-ene
CID 22743489
2,3,7,11-tetramethyldodec-2-enal
CID 142762169
(6E)-6,7-dimethylnona-1,6-diene
CID 22676542
6-butan-2-ylidene-3-ethyl-8,12-dimethyltrideca-1,7-diene
CID 123223648
6,10-diethyl-2,14-dimethylpentadeca-6,9-dien-8-one
CID 139998284
2-methylundecan-6-one
CID 86122551
3-ethyl-8-methylnon-2-ene
CID 91177846
amino 5-methylhexanoate
CID 18970778
(Z)-3,4-dimethylhept-3-ene;ethane;propane
CID 144674690
2,22-dimethyltricosane
CID 58100191

Frequently Asked Questions

What is the IUPAC name of 3,4,8-trimethylnon-3-ene?
The IUPAC name of 3,4,8-trimethylnon-3-ene (CID 123973517) is 3,4,8-trimethylnon-3-ene.
What is the SMILES notation for 3,4,8-trimethylnon-3-ene?
The canonical SMILES for 3,4,8-trimethylnon-3-ene is CCC(C)=C(C)CCCC(C)C.
What is the InChIKey of 3,4,8-trimethylnon-3-ene?
The InChIKey is UVXGFXYKFKSOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-6-11(4)12(5)9-7-8-10(2)3/h10H,6-9H2,1-5H3.
What are the key properties of 3,4,8-trimethylnon-3-ene?
3,4,8-trimethylnon-3-ene has a molecular weight of 168.32 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,8-trimethylnon-3-ene is sourced from PubChem (CID 123973517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).