(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene

C10H16ClF3 — CID 10933249

IUPAC(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene
SMILESCCCCCC/C(C)=C(\Cl)C(F)(F)F
InChIInChI=1S/C10H16ClF3/c1-3-4-5-6-7-8(2)9(11)10(12,13)14/h3-7H2,1-2H3/b9-8-
InChIKeyLACDCBHGPLQLKI-HJWRWDBZSA-N
MW228.68 g/mol
LogP5.03
Rot. Bonds5

About (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene

(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene (PubChem CID 10933249) has the molecular formula C10H16ClF3 and a molecular weight of 228.68 g/mol. Its IUPAC name is (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene.

Molecular Properties

Compound Name(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene
PubChem CID10933249
Molecular FormulaC10H16ClF3
Molecular Weight228.68 g/mol
Exact Mass228.09
IUPAC Name(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene
SMILESCCCCCC/C(C)=C(\Cl)C(F)(F)F
InChIInChI=1S/C10H16ClF3/c1-3-4-5-6-7-8(2)9(11)10(12,13)14/h3-7H2,1-2H3/b9-8-
InChIKeyLACDCBHGPLQLKI-HJWRWDBZSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500228.68
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene 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 (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene?
The IUPAC name of (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene (CID 10933249) is (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene.
What is the SMILES notation for (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene?
The canonical SMILES for (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene is CCCCCC/C(C)=C(\Cl)C(F)(F)F.
What is the InChIKey of (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene?
The InChIKey is LACDCBHGPLQLKI-HJWRWDBZSA-N. The full InChI is InChI=1S/C10H16ClF3/c1-3-4-5-6-7-8(2)9(11)10(12,13)14/h3-7H2,1-2H3/b9-8-.
What are the key properties of (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene?
(Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene has a molecular weight of 228.68 g/mol, XLogP of 5.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-chloro-1,1,1-trifluoro-3-methylnon-2-ene is sourced from PubChem (CID 10933249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).