1-Iododecane
Properties
- Molecular formula
- C10H21I
- Molar mass
- 268.18 g/mol
- Exact mass
- 268.0688 Da
- Density
- 1.2567 g/mL (at 20 °C)
- Melting point
- −16.3 °C
- Boiling point
- 132 °C
- logP
- 4.56Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 8
Hazards
Warning
- H315 Causes skin irritation97.9% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation87.2% of notifiers
- H413 May cause long lasting harmful effects to aquatic life80.9% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2050-77-3SMILES
CCCCCCCCCCIInChIKey
SKIDNYUZJPMKFC-UHFFFAOYSA-NInChI
InChI=1S/C10H21I/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Decane, 1-iodo-
- Decyl iodide
- n-Decyl iodide
- 1-Decyl iodide
Work with 1-Iododecane
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
1-Iodoheptane4282-40-0100 % similar
1-Iodononane4282-42-2100 % similar
Undecyl iodide4282-44-4100 % similar
1-Iodododecane4292-19-7100 % similar
1-Iodohexadecane544-77-4100 % similar
1-Iodooctane629-27-6100 % similar
1-Iodooctadecane629-93-6100 % similar
1-Iodohexane638-45-9100 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.