1,2,3-trifluoroprop-1-ene

C3H3F3 — CID 53395685

IUPAC1,2,3-trifluoroprop-1-ene
SMILESFC=C(F)CF
InChIInChI=1S/C3H3F3/c4-1-3(6)2-5/h1H,2H2
InChIKeyTXHNVFGQJAAUNB-UHFFFAOYSA-N
MW96.05 g/mol
LogP1.74
Rot. Bonds1

About 1,2,3-trifluoroprop-1-ene

1,2,3-trifluoroprop-1-ene (PubChem CID 53395685) has the molecular formula C3H3F3 and a molecular weight of 96.05 g/mol. Its IUPAC name is 1,2,3-trifluoroprop-1-ene.

Molecular Properties

Compound Name1,2,3-trifluoroprop-1-ene
PubChem CID53395685
Molecular FormulaC3H3F3
Molecular Weight96.05 g/mol
Exact Mass96.02
IUPAC Name1,2,3-trifluoroprop-1-ene
SMILESFC=C(F)CF
InChIInChI=1S/C3H3F3/c4-1-3(6)2-5/h1H,2H2
InChIKeyTXHNVFGQJAAUNB-UHFFFAOYSA-N
XLogP1.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.05
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3-trifluoroprop-1-ene?
The IUPAC name of 1,2,3-trifluoroprop-1-ene (CID 53395685) is 1,2,3-trifluoroprop-1-ene.
What is the SMILES notation for 1,2,3-trifluoroprop-1-ene?
The canonical SMILES for 1,2,3-trifluoroprop-1-ene is FC=C(F)CF.
What is the InChIKey of 1,2,3-trifluoroprop-1-ene?
The InChIKey is TXHNVFGQJAAUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F3/c4-1-3(6)2-5/h1H,2H2.
What are the key properties of 1,2,3-trifluoroprop-1-ene?
1,2,3-trifluoroprop-1-ene has a molecular weight of 96.05 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trifluoroprop-1-ene is sourced from PubChem (CID 53395685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).