4,9-dimethyldec-3-ene

C12H24 — CID 91170380

IUPAC4,9-dimethyldec-3-ene
SMILESCCC=C(C)CCCCC(C)C
InChIInChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h8,11H,5-7,9-10H2,1-4H3
InChIKeyHSGGWRIZCLGTSL-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds6

About 4,9-dimethyldec-3-ene

4,9-dimethyldec-3-ene (PubChem CID 91170380) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 4,9-dimethyldec-3-ene.

Molecular Properties

Compound Name4,9-dimethyldec-3-ene
PubChem CID91170380
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name4,9-dimethyldec-3-ene
SMILESCCC=C(C)CCCCC(C)C
InChIInChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h8,11H,5-7,9-10H2,1-4H3
InChIKeyHSGGWRIZCLGTSL-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(E)-4,8-dimethylnon-3-ene
CID 22743489
4-methylheptadec-3-ene
CID 59169426
4-methyloct-3-ene
CID 85445337
3,8-dimethylnon-2-enal
CID 91613839
(E)-3,7,11,15,20,24,28-heptamethylnonacos-2-en-1-ol
CID 174796442
3,7-dimethyldeca-2,7-diene
CID 173346067
(3Z,5E)-2,6,11-trimethyldodeca-1,3,5-triene
CID 142155642
1-chloro-4,8-dimethylnon-3-ene
CID 83163373
6,10-dimethylundec-5-en-2-ol
CID 57253097
(E)-3,7,11,15-tetramethyl(2,5,6,9,10,13,14-13C7)hexadec-2-en-1-ol
CID 10638184
(Z)-N,4,8-trimethylnon-3-en-1-amine
CID 83162608
3,12-dimethyltridec-2-enoic acid
CID 54254777

Frequently Asked Questions

What is the IUPAC name of 4,9-dimethyldec-3-ene?
The IUPAC name of 4,9-dimethyldec-3-ene (CID 91170380) is 4,9-dimethyldec-3-ene.
What is the SMILES notation for 4,9-dimethyldec-3-ene?
The canonical SMILES for 4,9-dimethyldec-3-ene is CCC=C(C)CCCCC(C)C.
What is the InChIKey of 4,9-dimethyldec-3-ene?
The InChIKey is HSGGWRIZCLGTSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h8,11H,5-7,9-10H2,1-4H3.
What are the key properties of 4,9-dimethyldec-3-ene?
4,9-dimethyldec-3-ene has a molecular weight of 168.32 g/mol, XLogP of 4.56, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,9-dimethyldec-3-ene is sourced from PubChem (CID 91170380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).