8-ethyl-8-fluoro-2-methyltetradec-1-ene

C17H33F — CID 174259517

IUPAC8-ethyl-8-fluoro-2-methyltetradec-1-ene
SMILESC=C(C)CCCCCC(F)(CC)CCCCCC
InChIInChI=1S/C17H33F/c1-5-7-8-11-14-17(18,6-2)15-12-9-10-13-16(3)4/h3,5-15H2,1-2,4H3
InChIKeyWPHZTXBEJZTIPU-UHFFFAOYSA-N
MW256.45 g/mol
LogP6.60
Rot. Bonds12

About 8-ethyl-8-fluoro-2-methyltetradec-1-ene

8-ethyl-8-fluoro-2-methyltetradec-1-ene (PubChem CID 174259517) has the molecular formula C17H33F and a molecular weight of 256.45 g/mol. Its IUPAC name is 8-ethyl-8-fluoro-2-methyltetradec-1-ene.

Molecular Properties

Compound Name8-ethyl-8-fluoro-2-methyltetradec-1-ene
PubChem CID174259517
Molecular FormulaC17H33F
Molecular Weight256.45 g/mol
Exact Mass256.26
IUPAC Name8-ethyl-8-fluoro-2-methyltetradec-1-ene
SMILESC=C(C)CCCCCC(F)(CC)CCCCCC
InChIInChI=1S/C17H33F/c1-5-7-8-11-14-17(18,6-2)15-12-9-10-13-16(3)4/h3,5-15H2,1-2,4H3
InChIKeyWPHZTXBEJZTIPU-UHFFFAOYSA-N
XLogP6.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.45
LogP ≤ 56.60
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-methyltetradec-1-ene
CID 521375
ethane;2-methyloct-1-ene
CID 143077596
ethane;2-methyloct-1-ene;propane
CID 177190898
ethane;2-methylhept-1-ene
CID 143682307
2-ethyl-2-fluorodecan-1-ol
CID 87200056
9-methylidenehenicosane;11-methylidenehenicosane;9-methylidenenonadecane;3-methylidenepentadecane;7-methylidenepentadecane;3-methylidenetridecane;5-methylidenetridecane;7-methylidenetridecane;5-methylideneundecane;2-methylpentadec-1-ene;2-methyltridec-1-ene
CID 173451985
2-methylhex-1-ene
CID 158402499
2,14-dimethylpentadeca-1,14-diene
CID 123962057
1-(8-methylnon-8-enoxy)dodecane
CID 10520052
8-heptoxy-2-methyloct-1-ene
CID 59205550
6-butyl-6-fluoroundecane
CID 11424735
2,20-dimethylhenicosa-1,20-diene;ethane;propane
CID 156639867

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-8-fluoro-2-methyltetradec-1-ene?
The IUPAC name of 8-ethyl-8-fluoro-2-methyltetradec-1-ene (CID 174259517) is 8-ethyl-8-fluoro-2-methyltetradec-1-ene.
What is the SMILES notation for 8-ethyl-8-fluoro-2-methyltetradec-1-ene?
The canonical SMILES for 8-ethyl-8-fluoro-2-methyltetradec-1-ene is C=C(C)CCCCCC(F)(CC)CCCCCC.
What is the InChIKey of 8-ethyl-8-fluoro-2-methyltetradec-1-ene?
The InChIKey is WPHZTXBEJZTIPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33F/c1-5-7-8-11-14-17(18,6-2)15-12-9-10-13-16(3)4/h3,5-15H2,1-2,4H3.
What are the key properties of 8-ethyl-8-fluoro-2-methyltetradec-1-ene?
8-ethyl-8-fluoro-2-methyltetradec-1-ene has a molecular weight of 256.45 g/mol, XLogP of 6.60, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-8-fluoro-2-methyltetradec-1-ene is sourced from PubChem (CID 174259517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).