(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene

C10H15F — CID 129119795

IUPAC(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene
SMILESC=C/C(=C\C=C/CF)C(C)C
InChIInChI=1S/C10H15F/c1-4-10(9(2)3)7-5-6-8-11/h4-7,9H,1,8H2,2-3H3/b6-5-,10-7+
InChIKeyAZOYAUVHUBXFPK-ZZWPSLBBSA-N
MW154.23 g/mol
LogP3.28
Rot. Bonds4

About (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene

(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene (PubChem CID 129119795) has the molecular formula C10H15F and a molecular weight of 154.23 g/mol. Its IUPAC name is (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene.

Molecular Properties

Compound Name(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene
PubChem CID129119795
Molecular FormulaC10H15F
Molecular Weight154.23 g/mol
Exact Mass154.12
IUPAC Name(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene
SMILESC=C/C(=C\C=C/CF)C(C)C
InChIInChI=1S/C10H15F/c1-4-10(9(2)3)7-5-6-8-11/h4-7,9H,1,8H2,2-3H3/b6-5-,10-7+
InChIKeyAZOYAUVHUBXFPK-ZZWPSLBBSA-N
XLogP3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.23
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene?
The IUPAC name of (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene (CID 129119795) is (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene.
What is the SMILES notation for (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene?
The canonical SMILES for (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene is C=C/C(=C\C=C/CF)C(C)C.
What is the InChIKey of (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene?
The InChIKey is AZOYAUVHUBXFPK-ZZWPSLBBSA-N. The full InChI is InChI=1S/C10H15F/c1-4-10(9(2)3)7-5-6-8-11/h4-7,9H,1,8H2,2-3H3/b6-5-,10-7+.
What are the key properties of (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene?
(3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene has a molecular weight of 154.23 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-7-fluoro-3-propan-2-ylhepta-1,3,5-triene is sourced from PubChem (CID 129119795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).