acetic acid;fluoroform

C3H5F3O2 — CID 87238268

IUPACacetic acid;fluoroform
SMILESCC(=O)O.FC(F)F
InChIInChI=1S/C2H4O2.CHF3/c1-2(3)4;2-1(3)4/h1H3,(H,3,4);1H
InChIKeySYHWDUQFWRGJGX-UHFFFAOYSA-N
MW130.06 g/mol
LogP1.27
Rot. Bonds

About acetic acid;fluoroform

acetic acid;fluoroform (PubChem CID 87238268) has the molecular formula C3H5F3O2 and a molecular weight of 130.06 g/mol. Its IUPAC name is acetic acid;fluoroform.

Molecular Properties

Compound Nameacetic acid;fluoroform
PubChem CID87238268
Molecular FormulaC3H5F3O2
Molecular Weight130.06 g/mol
Exact Mass130.02
IUPAC Nameacetic acid;fluoroform
SMILESCC(=O)O.FC(F)F
InChIInChI=1S/C2H4O2.CHF3/c1-2(3)4;2-1(3)4/h1H3,(H,3,4);1H
InChIKeySYHWDUQFWRGJGX-UHFFFAOYSA-N
XLogP1.27
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.06
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze acetic acid;fluoroform 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

acetic acid
CID 158444727
acetic acid;methanetriol
CID 174483633
carbonic acid;fluoroform;indigane
CID 174753992
acetic acid;vanadium
CID 59299810
acetic acid;stibane
CID 173054099
acetic acid;methanol
CID 173388753
acetic acid;ethane
CID 173226324
acetic acid;ethane
CID 173070051
acetic acid;cobalt
CID 54602348
acetic acid;tris(yttrium)
CID 59994727
acetic acid;nickel(2+)
CID 22169473
acetic acid;cobalt
CID 59294242

Frequently Asked Questions

What is the IUPAC name of acetic acid;fluoroform?
The IUPAC name of acetic acid;fluoroform (CID 87238268) is acetic acid;fluoroform.
What is the SMILES notation for acetic acid;fluoroform?
The canonical SMILES for acetic acid;fluoroform is CC(=O)O.FC(F)F.
What is the InChIKey of acetic acid;fluoroform?
The InChIKey is SYHWDUQFWRGJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.CHF3/c1-2(3)4;2-1(3)4/h1H3,(H,3,4);1H.
What are the key properties of acetic acid;fluoroform?
acetic acid;fluoroform has a molecular weight of 130.06 g/mol, XLogP of 1.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;fluoroform is sourced from PubChem (CID 87238268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).