5-ethyl-4-methylnon-4-ene

C12H24 — CID 143021471

IUPAC5-ethyl-4-methylnon-4-ene
SMILESCCCCC(CC)=C(C)CCC
InChIInChI=1S/C12H24/c1-5-8-10-12(7-3)11(4)9-6-2/h5-10H2,1-4H3
InChIKeyDVVCRXGLQZVZSC-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.70
Rot. Bonds6

About 5-ethyl-4-methylnon-4-ene

5-ethyl-4-methylnon-4-ene (PubChem CID 143021471) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 5-ethyl-4-methylnon-4-ene.

Molecular Properties

Compound Name5-ethyl-4-methylnon-4-ene
PubChem CID143021471
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name5-ethyl-4-methylnon-4-ene
SMILESCCCCC(CC)=C(C)CCC
InChIInChI=1S/C12H24/c1-5-8-10-12(7-3)11(4)9-6-2/h5-10H2,1-4H3
InChIKeyDVVCRXGLQZVZSC-UHFFFAOYSA-N
XLogP4.70
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 ≤ 54.70
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-methyl-4-propyloct-3-ene
CID 57107532
6-ethyl-7-methyl-3-methylidenedeca-1,6-diene
CID 54189290
10-methyl-9-propylicos-9-ene
CID 57290137
(Z)-10-methyl-9-propylicos-9-ene
CID 18601799
6-butyl-7-ethyltetradec-6-ene
CID 57142303
10-butyl-11-ethyldocos-10-ene
CID 57219160
(E)-4,5-dimethyloct-4-ene
CID 12714364
5,6-dibutyltetradec-5-ene
CID 19866346
(E)-3-propyloct-2-en-2-ol
CID 142123066
3-methylhept-2-en-2-ol
CID 73309482
5-(difluoromethylidene)nonane
CID 86233125
(Z)-3,4-dimethylhept-3-ene;ethane;propane
CID 144674690

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methylnon-4-ene?
The IUPAC name of 5-ethyl-4-methylnon-4-ene (CID 143021471) is 5-ethyl-4-methylnon-4-ene.
What is the SMILES notation for 5-ethyl-4-methylnon-4-ene?
The canonical SMILES for 5-ethyl-4-methylnon-4-ene is CCCCC(CC)=C(C)CCC.
What is the InChIKey of 5-ethyl-4-methylnon-4-ene?
The InChIKey is DVVCRXGLQZVZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-8-10-12(7-3)11(4)9-6-2/h5-10H2,1-4H3.
What are the key properties of 5-ethyl-4-methylnon-4-ene?
5-ethyl-4-methylnon-4-ene has a molecular weight of 168.32 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methylnon-4-ene is sourced from PubChem (CID 143021471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).