cyclopropanecarboxylic acid;hydroiodide

C4H7IO2 — CID 67700319

IUPACcyclopropanecarboxylic acid;hydroiodide
SMILESI.O=C(O)C1CC1
InChIInChI=1S/C4H6O2.HI/c5-4(6)3-1-2-3;/h3H,1-2H2,(H,5,6);1H
InChIKeyILKCNNDXDTUENY-UHFFFAOYSA-N
MW214.00 g/mol
LogP1.10
Rot. Bonds1

About cyclopropanecarboxylic acid;hydroiodide

cyclopropanecarboxylic acid;hydroiodide (PubChem CID 67700319) has the molecular formula C4H7IO2 and a molecular weight of 214.00 g/mol. Its IUPAC name is cyclopropanecarboxylic acid;hydroiodide.

Molecular Properties

Compound Namecyclopropanecarboxylic acid;hydroiodide
PubChem CID67700319
Molecular FormulaC4H7IO2
Molecular Weight214.00 g/mol
Exact Mass213.95
IUPAC Namecyclopropanecarboxylic acid;hydroiodide
SMILESI.O=C(O)C1CC1
InChIInChI=1S/C4H6O2.HI/c5-4(6)3-1-2-3;/h3H,1-2H2,(H,5,6);1H
InChIKeyILKCNNDXDTUENY-UHFFFAOYSA-N
XLogP1.10
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.00
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

cyclohexane-1,4-dicarboxylic acid;hydrobromide
CID 70215185
cyclohexane-1,4-dicarboxylic acid;cyclopentane-1,3-dicarboxylic acid
CID 161475893
cyclohexane-1,4-dicarboxylic acid;formic acid
CID 157153528
cyclopentanecarboxylic acid
CID 18840
(3S)-cyclopentane-1,3-dicarboxylic acid
CID 138481198
(4-carboxycyclohexyl)azanium
CID 4518459
cyclopentanecarboxylic acid;indigane
CID 173230713
cyclotetracosanecarboxylic acid
CID 176986816
cyclooctadecane-1,7,13-tricarboxylic acid
CID 10715056
cyclohexanecarboxylic acid
CID 11286469
cyclobutanecarboxylic acid;hydrofluoride
CID 161438543
cyclohexane-1,4-dicarboxylic acid;prop-1-ene
CID 70631081

Frequently Asked Questions

What is the IUPAC name of cyclopropanecarboxylic acid;hydroiodide?
The IUPAC name of cyclopropanecarboxylic acid;hydroiodide (CID 67700319) is cyclopropanecarboxylic acid;hydroiodide.
What is the SMILES notation for cyclopropanecarboxylic acid;hydroiodide?
The canonical SMILES for cyclopropanecarboxylic acid;hydroiodide is I.O=C(O)C1CC1.
What is the InChIKey of cyclopropanecarboxylic acid;hydroiodide?
The InChIKey is ILKCNNDXDTUENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2.HI/c5-4(6)3-1-2-3;/h3H,1-2H2,(H,5,6);1H.
What are the key properties of cyclopropanecarboxylic acid;hydroiodide?
cyclopropanecarboxylic acid;hydroiodide has a molecular weight of 214.00 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanecarboxylic acid;hydroiodide is sourced from PubChem (CID 67700319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).