Iodocyclopentane
Properties
- Molecular formula
- C5H9I
- Molar mass
- 196.03 g/mol
- Exact mass
- 195.9749 Da
- Density
- 1.1754 g/mL (at 0 °C)
- Boiling point
- 166.5 °C
- logP
- 2.36Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H226 Flammable liquid and vapor97.9% of notifiers
- H315 Causes skin irritation14.6% of notifiers
- H319 Causes serious eye irritation14.6% of notifiers
- H335 May cause respiratory irritation14.6% of notifiers
Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
1556-18-9SMILES
IC1CCCC1InChIKey
PCEBAZIVZVIQEO-UHFFFAOYSA-NInChI
InChI=1S/C5H9I/c6-5-3-1-2-4-5/h5H,1-4H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Cyclopentane iodide
- Cyclopentane, iodo-
- Cyclopentyl iodide
- 1-Iodocyclopentane
- NSC 6071
Work with Iodocyclopentane
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Iodocyclohexane626-62-092 % similar
4-Iodotetrahydro-2H-pyran25637-18-747 % similar
cis-Decalin493-01-636 % similar
trans-Decalin493-02-736 % similar
Decalin91-17-836 % similar
3-Iodooxetane26272-85-535 % similar
Tetrahydro-3-iodofuran121138-01-035 % similar
Bicyclohexyl92-51-333 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.