1-Bromo-5-chloropentane
Properties
- Molecular formula
- C5H10BrCl
- Molar mass
- 185.49 g/mol
- Exact mass
- 183.9654 Da
- Density
- 1.488 g/mL (at 15 °C)
- Boiling point
- 210–212 °C
- logP
- 2.79Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 4
Hazards
Warning
- H302 Harmful if swallowed28.6% of notifiers
- H315 Causes skin irritation85.7% of notifiers
- H316 Causes mild skin irritation14.3% of notifiers
- H319 Causes serious eye irritation85.7% of notifiers
- H335 May cause respiratory irritation57.1% of notifiers
- H411 Toxic to aquatic life with long lasting effects28.6% of notifiers
Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
54512-75-3SMILES
ClCCCCCBrInChIKey
PHHNNDKXQVKJEP-UHFFFAOYSA-NInChI
InChI=1S/C5H10BrCl/c6-4-2-1-3-5-7/h1-5H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Pentane, 1-bromo-5-chloro-
- NSC 50474
- 5-Chloropentyl bromide
- 5-Bromo-1-chloropentane
Work with 1-Bromo-5-chloropentane
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-Bromo-6-chlorohexane6294-17-3100 % similar
1-Bromo-4-chlorobutane6940-78-993 % similar
1-Bromo-3-chloropropane109-70-675 % similar
1,5-Dibromopentane111-24-060 % similar
1,11-Dibromoundecane16696-65-460 % similar
1,10-Dichlorodecane2162-98-360 % similar
1,8-Dichlorooctane2162-99-460 % similar
1,6-Dichlorohexane2163-00-060 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.