5-fluoro-2,7,10-trimethylundec-3-ene

C14H27F — CID 123599295

IUPAC5-fluoro-2,7,10-trimethylundec-3-ene
SMILESCC(C)C=CC(F)CC(C)CCC(C)C
InChIInChI=1S/C14H27F/c1-11(2)6-8-13(5)10-14(15)9-7-12(3)4/h7,9,11-14H,6,8,10H2,1-5H3
InChIKeyNRATWLRULVBDLH-UHFFFAOYSA-N
MW214.37 g/mol
LogP5.00
Rot. Bonds7

About 5-fluoro-2,7,10-trimethylundec-3-ene

5-fluoro-2,7,10-trimethylundec-3-ene (PubChem CID 123599295) has the molecular formula C14H27F and a molecular weight of 214.37 g/mol. Its IUPAC name is 5-fluoro-2,7,10-trimethylundec-3-ene.

Molecular Properties

Compound Name5-fluoro-2,7,10-trimethylundec-3-ene
PubChem CID123599295
Molecular FormulaC14H27F
Molecular Weight214.37 g/mol
Exact Mass214.21
IUPAC Name5-fluoro-2,7,10-trimethylundec-3-ene
SMILESCC(C)C=CC(F)CC(C)CCC(C)C
InChIInChI=1S/C14H27F/c1-11(2)6-8-13(5)10-14(15)9-7-12(3)4/h7,9,11-14H,6,8,10H2,1-5H3
InChIKeyNRATWLRULVBDLH-UHFFFAOYSA-N
XLogP5.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.37
LogP ≤ 55.00
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

Cyclohexene, 4-methyl-1-(1-methylethyl)-
CID 10369
trans-Isolimonene
CID 22831540
Cyclohexene, 1-methyl-3-(1-methylethenyl)-
CID 10354
(3R-trans)-3-Methyl-6-(1-methylvinyl)cyclohexene
CID 78790
8-Methyldec-1-ene
CID 521957
2,6,10,15,19,23-Hexamethyltetracosene
CID 6437646
3-(1-Methylethyl)cyclohexene
CID 520966
3-(2-Methylpropyl)cyclohex-1-ene
CID 20057
4,6,8-Trimethyl-1-nonene
CID 41077
Cyclohexene, 3-propyl-
CID 138092
2-Menthene
CID 517974
Isolimonene
CID 521268

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,7,10-trimethylundec-3-ene?
The IUPAC name of 5-fluoro-2,7,10-trimethylundec-3-ene (CID 123599295) is 5-fluoro-2,7,10-trimethylundec-3-ene.
What is the SMILES notation for 5-fluoro-2,7,10-trimethylundec-3-ene?
The canonical SMILES for 5-fluoro-2,7,10-trimethylundec-3-ene is CC(C)C=CC(F)CC(C)CCC(C)C.
What is the InChIKey of 5-fluoro-2,7,10-trimethylundec-3-ene?
The InChIKey is NRATWLRULVBDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27F/c1-11(2)6-8-13(5)10-14(15)9-7-12(3)4/h7,9,11-14H,6,8,10H2,1-5H3.
What are the key properties of 5-fluoro-2,7,10-trimethylundec-3-ene?
5-fluoro-2,7,10-trimethylundec-3-ene has a molecular weight of 214.37 g/mol, XLogP of 5.00, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,7,10-trimethylundec-3-ene is sourced from PubChem (CID 123599295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).