carbonic acid;2,3-difluoroprop-1-ene

C4H6F2O3 — CID 135262079

IUPACcarbonic acid;2,3-difluoroprop-1-ene
SMILESC=C(F)CF.O=C(O)O
InChIInChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h1-2H2;(H2,2,3,4)
InChIKeyKMPZRLWFHAGMLO-UHFFFAOYSA-N
MW140.08 g/mol
LogP1.66
Rot. Bonds1

About carbonic acid;2,3-difluoroprop-1-ene

carbonic acid;2,3-difluoroprop-1-ene (PubChem CID 135262079) has the molecular formula C4H6F2O3 and a molecular weight of 140.08 g/mol. Its IUPAC name is carbonic acid;2,3-difluoroprop-1-ene.

Molecular Properties

Compound Namecarbonic acid;2,3-difluoroprop-1-ene
PubChem CID135262079
Molecular FormulaC4H6F2O3
Molecular Weight140.08 g/mol
Exact Mass140.03
IUPAC Namecarbonic acid;2,3-difluoroprop-1-ene
SMILESC=C(F)CF.O=C(O)O
InChIInChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h1-2H2;(H2,2,3,4)
InChIKeyKMPZRLWFHAGMLO-UHFFFAOYSA-N
XLogP1.66
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;2,3-difluoroprop-1-ene?
The IUPAC name of carbonic acid;2,3-difluoroprop-1-ene (CID 135262079) is carbonic acid;2,3-difluoroprop-1-ene.
What is the SMILES notation for carbonic acid;2,3-difluoroprop-1-ene?
The canonical SMILES for carbonic acid;2,3-difluoroprop-1-ene is C=C(F)CF.O=C(O)O.
What is the InChIKey of carbonic acid;2,3-difluoroprop-1-ene?
The InChIKey is KMPZRLWFHAGMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F2.CH2O3/c1-3(5)2-4;2-1(3)4/h1-2H2;(H2,2,3,4).
What are the key properties of carbonic acid;2,3-difluoroprop-1-ene?
carbonic acid;2,3-difluoroprop-1-ene has a molecular weight of 140.08 g/mol, XLogP of 1.66, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;2,3-difluoroprop-1-ene is sourced from PubChem (CID 135262079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).