1,1,3-trifluoro-2-methylprop-1-ene

C4H5F3 — CID 19788889

IUPAC1,1,3-trifluoro-2-methylprop-1-ene
SMILESCC(CF)=C(F)F
InChIInChI=1S/C4H5F3/c1-3(2-5)4(6)7/h2H2,1H3
InChIKeyCAMBEDOMHIQIKW-UHFFFAOYSA-N
MW110.08 g/mol
LogP2.13
Rot. Bonds1

About 1,1,3-trifluoro-2-methylprop-1-ene

1,1,3-trifluoro-2-methylprop-1-ene (PubChem CID 19788889) has the molecular formula C4H5F3 and a molecular weight of 110.08 g/mol. Its IUPAC name is 1,1,3-trifluoro-2-methylprop-1-ene.

Molecular Properties

Compound Name1,1,3-trifluoro-2-methylprop-1-ene
PubChem CID19788889
Molecular FormulaC4H5F3
Molecular Weight110.08 g/mol
Exact Mass110.03
IUPAC Name1,1,3-trifluoro-2-methylprop-1-ene
SMILESCC(CF)=C(F)F
InChIInChI=1S/C4H5F3/c1-3(2-5)4(6)7/h2H2,1H3
InChIKeyCAMBEDOMHIQIKW-UHFFFAOYSA-N
XLogP2.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.08
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,1,3-trifluoro-2-methylprop-1-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 1,1,3-trifluoro-2-methylprop-1-ene?
The IUPAC name of 1,1,3-trifluoro-2-methylprop-1-ene (CID 19788889) is 1,1,3-trifluoro-2-methylprop-1-ene.
What is the SMILES notation for 1,1,3-trifluoro-2-methylprop-1-ene?
The canonical SMILES for 1,1,3-trifluoro-2-methylprop-1-ene is CC(CF)=C(F)F.
What is the InChIKey of 1,1,3-trifluoro-2-methylprop-1-ene?
The InChIKey is CAMBEDOMHIQIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5F3/c1-3(2-5)4(6)7/h2H2,1H3.
What are the key properties of 1,1,3-trifluoro-2-methylprop-1-ene?
1,1,3-trifluoro-2-methylprop-1-ene has a molecular weight of 110.08 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-trifluoro-2-methylprop-1-ene is sourced from PubChem (CID 19788889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).