2,7-dimethyldec-2-ene

C12H24 — CID 123304905

IUPAC2,7-dimethyldec-2-ene
SMILESCCCC(C)CCCC=C(C)C
InChIInChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h9,12H,5-8,10H2,1-4H3
InChIKeyPABWFWQEOYIHEN-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds6

About 2,7-dimethyldec-2-ene

2,7-dimethyldec-2-ene (PubChem CID 123304905) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 2,7-dimethyldec-2-ene.

Molecular Properties

Compound Name2,7-dimethyldec-2-ene
PubChem CID123304905
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name2,7-dimethyldec-2-ene
SMILESCCCC(C)CCCC=C(C)C
InChIInChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h9,12H,5-8,10H2,1-4H3
InChIKeyPABWFWQEOYIHEN-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

2,6,10-trimethyltridec-2-en-7-ol
CID 88508201
2,6,10-trimethylundec-2-ene
CID 14805750
2,6,10,13-tetramethyltetradec-2-ene
CID 58292520
8,12-dimethyltridec-11-en-4-one
CID 71359316
2,6-dimethyl-10-(trideuteriomethyl)dodec-2-ene
CID 11252860
(7R,8S)-2-methyloctadec-2-ene-7,8-diol
CID 13420628
3,7-dimethyloct-6-en-1-ol;hexanal
CID 88603702
6,10-dimethylundec-9-en-1-yne
CID 175139097
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine
CID 173154229
diethyl 2-(5-methylhex-4-enyl)propanedioate
CID 10999682

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyldec-2-ene?
The IUPAC name of 2,7-dimethyldec-2-ene (CID 123304905) is 2,7-dimethyldec-2-ene.
What is the SMILES notation for 2,7-dimethyldec-2-ene?
The canonical SMILES for 2,7-dimethyldec-2-ene is CCCC(C)CCCC=C(C)C.
What is the InChIKey of 2,7-dimethyldec-2-ene?
The InChIKey is PABWFWQEOYIHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-8-12(4)10-7-6-9-11(2)3/h9,12H,5-8,10H2,1-4H3.
What are the key properties of 2,7-dimethyldec-2-ene?
2,7-dimethyldec-2-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 2,7-dimethyldec-2-ene is sourced from PubChem (CID 123304905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).