1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane

C17H29F5O — CID 175204949

IUPAC1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane
SMILESCCCCCCCCCCCCCCOC(F)=C(F)C(F)(F)F
InChIInChI=1S/C17H29F5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-16(19)15(18)17(20,21)22/h2-14H2,1H3
InChIKeyCFPBPRWVIZTNJJ-UHFFFAOYSA-N
MW344.41 g/mol
LogP7.37
Rot. Bonds14

About 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane

1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane (PubChem CID 175204949) has the molecular formula C17H29F5O and a molecular weight of 344.41 g/mol. Its IUPAC name is 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane.

Molecular Properties

Compound Name1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane
PubChem CID175204949
Molecular FormulaC17H29F5O
Molecular Weight344.41 g/mol
Exact Mass344.21
IUPAC Name1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane
SMILESCCCCCCCCCCCCCCOC(F)=C(F)C(F)(F)F
InChIInChI=1S/C17H29F5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-16(19)15(18)17(20,21)22/h2-14H2,1H3
InChIKeyCFPBPRWVIZTNJJ-UHFFFAOYSA-N
XLogP7.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.41
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2,3,3,4,4,5,5,6,6,6-undecafluoro-1-hexoxyhex-1-ene
CID 175759743
1,2,3,3,4,4,5,5,5-nonafluoro-1-pentoxypent-1-ene
CID 175759689
tricosyl 2,2,2-trifluoroacetate
CID 14574257
tetracosyl 2,2,2-trifluoroacetate
CID 91692950
octyl 2,2,2-trifluoroacetate
CID 520219
sodium;dodecyl 2,2,2-trifluoroacetate;hydride
CID 175457015
dihexyl 2,2-difluoropropanedioate
CID 154336764
1-[1,1,1,4,4,5,5,5-octafluoro-2-(trifluoromethyl)pent-2-en-3-yl]oxyoctane
CID 12726234
decyl 2,2,3,3,3-pentafluoropropanoate
CID 536957
heptadecane;hypofluorous acid
CID 158426244
undecyl 2-[(2,2,2-trifluoroacetyl)amino]acetate
CID 91693601
1-oct-1-en-2-yloxydodecane
CID 58247133

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane?
The IUPAC name of 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane (CID 175204949) is 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane.
What is the SMILES notation for 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane?
The canonical SMILES for 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane is CCCCCCCCCCCCCCOC(F)=C(F)C(F)(F)F.
What is the InChIKey of 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane?
The InChIKey is CFPBPRWVIZTNJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29F5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-16(19)15(18)17(20,21)22/h2-14H2,1H3.
What are the key properties of 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane?
1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane has a molecular weight of 344.41 g/mol, XLogP of 7.37, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,3,3-pentafluoroprop-1-enoxy)tetradecane is sourced from PubChem (CID 175204949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).