cyclopropyl thiohypoiodite

C3H5IS — CID 126554141

IUPACcyclopropyl thiohypoiodite
SMILESISC1CC1
InChIInChI=1S/C3H5IS/c4-5-3-1-2-3/h3H,1-2H2
InChIKeyOFPAPWLYDMTSAZ-UHFFFAOYSA-N
MW200.04 g/mol
LogP2.23
Rot. Bonds1

About cyclopropyl thiohypoiodite

cyclopropyl thiohypoiodite (PubChem CID 126554141) has the molecular formula C3H5IS and a molecular weight of 200.04 g/mol. Its IUPAC name is cyclopropyl thiohypoiodite.

Molecular Properties

Compound Namecyclopropyl thiohypoiodite
PubChem CID126554141
Molecular FormulaC3H5IS
Molecular Weight200.04 g/mol
Exact Mass199.92
IUPAC Namecyclopropyl thiohypoiodite
SMILESISC1CC1
InChIInChI=1S/C3H5IS/c4-5-3-1-2-3/h3H,1-2H2
InChIKeyOFPAPWLYDMTSAZ-UHFFFAOYSA-N
XLogP2.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.04
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methylsulfanylcyclopropane
CID 12678402
hydroperoxysulfanylcyclopropane
CID 118101237
1,2,3-triiodocyclopentane
CID 122583562
S-(4-hydroxycyclohexyl) ethanethioate
CID 97349473
ethane;1-methyl-4-methylsulfanylcyclohexane
CID 144625418
1-(disulfanyl)-4-fluorocyclohexane
CID 87424436
2-cyclopropylsulfanylethanamine
CID 58684646
1-cyclopropylsulfanylethanethiol
CID 175507256
1-cyclopentyl-4-methylsulfanylcyclohexane
CID 152799739
S-cyclobutyl ethanethioate
CID 91113271
butan-2-ylsulfanylcyclopropane
CID 59881925
cis-(1S,3R)-3-methylsulfanylcyclopentan-1-amine
CID 95566531

Frequently Asked Questions

What is the IUPAC name of cyclopropyl thiohypoiodite?
The IUPAC name of cyclopropyl thiohypoiodite (CID 126554141) is cyclopropyl thiohypoiodite.
What is the SMILES notation for cyclopropyl thiohypoiodite?
The canonical SMILES for cyclopropyl thiohypoiodite is ISC1CC1.
What is the InChIKey of cyclopropyl thiohypoiodite?
The InChIKey is OFPAPWLYDMTSAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5IS/c4-5-3-1-2-3/h3H,1-2H2.
What are the key properties of cyclopropyl thiohypoiodite?
cyclopropyl thiohypoiodite has a molecular weight of 200.04 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl thiohypoiodite is sourced from PubChem (CID 126554141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).