carbonic acid;(E)-1,2-difluoroprop-1-ene

C4H6F2O3 — CID 88574369

IUPACcarbonic acid;(E)-1,2-difluoroprop-1-ene
SMILESC/C(F)=C\F.O=C(O)O
InChIInChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h2H,1H3;(H2,2,3,4)/b3-2+;
InChIKeyIYTXQFMZEDAPHE-SQQVDAMQSA-N
MW140.08 g/mol
LogP2.01
Rot. Bonds

About carbonic acid;(E)-1,2-difluoroprop-1-ene

carbonic acid;(E)-1,2-difluoroprop-1-ene (PubChem CID 88574369) has the molecular formula C4H6F2O3 and a molecular weight of 140.08 g/mol. Its IUPAC name is carbonic acid;(E)-1,2-difluoroprop-1-ene.

Molecular Properties

Compound Namecarbonic acid;(E)-1,2-difluoroprop-1-ene
PubChem CID88574369
Molecular FormulaC4H6F2O3
Molecular Weight140.08 g/mol
Exact Mass140.03
IUPAC Namecarbonic acid;(E)-1,2-difluoroprop-1-ene
SMILESC/C(F)=C\F.O=C(O)O
InChIInChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h2H,1H3;(H2,2,3,4)/b3-2+;
InChIKeyIYTXQFMZEDAPHE-SQQVDAMQSA-N
XLogP2.01
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze carbonic acid;(E)-1,2-difluoroprop-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

Related Compounds

(E)-1-fluoroprop-1-en-2-ol
CID 142873409
acetic acid;carbonic acid
CID 157418112
(E)-1,2-difluoroprop-1-ene;trifluoro(methoxy)methane
CID 165078646
acetic acid;azane;zirconium
CID 173280365
acetic acid;carbonic acid;ethane
CID 87357637
tris(carbonofluoridic acid);fluoromethane
CID 175227828
butane-2,3-dione;carbonic acid
CID 174891727
acetyl fluoride;hydrochloride
CID 157205007
carbonic acid;fluoroethene;methoxymethane
CID 175504399
acetic acid
CID 158444727
propan-2-one;zirconium
CID 87087539
CID 5359261
CID 5359261

Frequently Asked Questions

What is the IUPAC name of carbonic acid;(E)-1,2-difluoroprop-1-ene?
The IUPAC name of carbonic acid;(E)-1,2-difluoroprop-1-ene (CID 88574369) is carbonic acid;(E)-1,2-difluoroprop-1-ene.
What is the SMILES notation for carbonic acid;(E)-1,2-difluoroprop-1-ene?
The canonical SMILES for carbonic acid;(E)-1,2-difluoroprop-1-ene is C/C(F)=C\F.O=C(O)O.
What is the InChIKey of carbonic acid;(E)-1,2-difluoroprop-1-ene?
The InChIKey is IYTXQFMZEDAPHE-SQQVDAMQSA-N. The full InChI is InChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h2H,1H3;(H2,2,3,4)/b3-2+;.
What are the key properties of carbonic acid;(E)-1,2-difluoroprop-1-ene?
carbonic acid;(E)-1,2-difluoroprop-1-ene has a molecular weight of 140.08 g/mol, XLogP of 2.01, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;(E)-1,2-difluoroprop-1-ene is sourced from PubChem (CID 88574369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).