1-Bromopentane

C₅H₁₁BrCAS 110-53-2151.05 g/mol

Open in Covalent MOL file

Alkyl halide

Properties

Molecular formula: C₅H₁₁Br
Molar mass: 151.05 g/mol
Exact mass: 150.0044 Da
Density: 1.2426 g/mL (at 0 °C)
Melting point: −95 °C
Boiling point: 129.8 °C
logP: 2.57Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation91.2% of notifiers
H335 May cause respiratory irritation89.7% of notifiers
H411 Toxic to aquatic life with long lasting effects19.1% 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, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

110-53-2

SMILES

CCCCCBr

InChIKey

YZWKKMVJZFACSU-UHFFFAOYSA-N

InChI

InChI=1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names

Pentane, 1-bromo-
n-Amyl bromide
n-Pentyl bromide
Amyl bromide
Pentyl bromide
1-Pentyl bromide
NSC 7895

Work with 1-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

1-Bromohexane111-25-193 % similar 1-Bromooctane111-83-193 % similar 1-Bromodecane112-29-893 % similar 1-Bromotetradecane112-71-093 % similar 1-Bromohexadecane112-82-393 % similar 1-Bromooctadecane112-89-093 % similar 1-Bromododecane143-15-793 % similar 1-Bromoheptadecane3508-00-793 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Bromo-2-methylbutane10422-35-2 2-Bromopentane107-81-3 1-Bromo-3-methylbutane107-82-4 3-Bromopentane1809-10-5 2-Bromo-2-methylbutane507-36-8 (2S)-1-Bromo-2-methylbutane534-00-9 1-Bromo-2,2-dimethylpropane630-17-1

Elsewhere

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