(E)-1,1,1-trifluorodec-4-ene

C10H17F3 — CID 87295897

IUPAC(E)-1,1,1-trifluorodec-4-ene
SMILESCCCCC/C=C/CCC(F)(F)F
InChIInChI=1S/C10H17F3/c1-2-3-4-5-6-7-8-9-10(11,12)13/h6-7H,2-5,8-9H2,1H3/b7-6+
InChIKeyJIAYRLXYOGSAMT-VOTSOKGWSA-N
MW194.24 g/mol
LogP4.47
Rot. Bonds6

About (E)-1,1,1-trifluorodec-4-ene

(E)-1,1,1-trifluorodec-4-ene (PubChem CID 87295897) has the molecular formula C10H17F3 and a molecular weight of 194.24 g/mol. Its IUPAC name is (E)-1,1,1-trifluorodec-4-ene.

Molecular Properties

Compound Name(E)-1,1,1-trifluorodec-4-ene
PubChem CID87295897
Molecular FormulaC10H17F3
Molecular Weight194.24 g/mol
Exact Mass194.13
IUPAC Name(E)-1,1,1-trifluorodec-4-ene
SMILESCCCCC/C=C/CCC(F)(F)F
InChIInChI=1S/C10H17F3/c1-2-3-4-5-6-7-8-9-10(11,12)13/h6-7H,2-5,8-9H2,1H3/b7-6+
InChIKeyJIAYRLXYOGSAMT-VOTSOKGWSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 54.47
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'}

Analyze (E)-1,1,1-trifluorodec-4-ene 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

(E)-non-3-ene
CID 5364445
(Z)-2,2-dimethyldodec-5-ene
CID 153455160
(Z)-docos-9-ene
CID 11690102
(E)-hexadec-6-ene
CID 5352260
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020
triacont-12-ene
CID 54535715
(Z)-octadec-6-ene
CID 5352239

Frequently Asked Questions

What is the IUPAC name of (E)-1,1,1-trifluorodec-4-ene?
The IUPAC name of (E)-1,1,1-trifluorodec-4-ene (CID 87295897) is (E)-1,1,1-trifluorodec-4-ene.
What is the SMILES notation for (E)-1,1,1-trifluorodec-4-ene?
The canonical SMILES for (E)-1,1,1-trifluorodec-4-ene is CCCCC/C=C/CCC(F)(F)F.
What is the InChIKey of (E)-1,1,1-trifluorodec-4-ene?
The InChIKey is JIAYRLXYOGSAMT-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H17F3/c1-2-3-4-5-6-7-8-9-10(11,12)13/h6-7H,2-5,8-9H2,1H3/b7-6+.
What are the key properties of (E)-1,1,1-trifluorodec-4-ene?
(E)-1,1,1-trifluorodec-4-ene has a molecular weight of 194.24 g/mol, XLogP of 4.47, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,1,1-trifluorodec-4-ene is sourced from PubChem (CID 87295897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).