2-Bromopentane
Properties
- Molecular formula
- C5H11Br
- Molar mass
- 151.05 g/mol
- Exact mass
- 150.0044 Da
- Density
- 1.208 g/mL (at 20 °C)
- Melting point
- −95.5 °C
- Boiling point
- 117.4 °C
- Flash point
- 20.6 °C
- logP
- 2.57Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Hazards
Danger
- H225 Highly Flammable liquid and vapor70.6% of notifiers
- H226 Flammable liquid and vapor29.4% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation95.6% of notifiers
- H335 May cause respiratory irritation66.2% of notifiers
Aggregated from 68 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
107-81-3SMILES
CCCC(C)BrInChIKey
LGAJYTCRJPCZRJ-UHFFFAOYSA-NInChI
InChI=1S/C5H11Br/c1-3-4-5(2)6/h5H,3-4H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Pentane, 2-bromo-
- 2-Pentyl bromide
- (±)-2-Bromopentane
- NSC 7896
Work with 2-Bromopentane
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
2-Bromohexane3377-86-470 % similar
2-Bromoheptane1974-04-567 % similar
2,5-Dibromohexane24774-58-165 % similar
sec-Octyl bromide557-35-764 % similar
1,3-Dibromobutane107-80-252 % similar
2-Bromobutane78-76-250 % similar
1,4-Dibromopentane626-87-948 % similar
2,4-Dibromopentane19398-53-947 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds