1-Bromo-2,2-dimethylpropane

C₅H₁₁BrCAS 630-17-1151.05 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₁₁Br
Molar mass: 151.05 g/mol
Exact mass: 150.0044 Da
Density: 1.2 g/mL (at 20 °C)
Boiling point: 106 °C
logP: 2.43Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

630-17-1

SMILES

CC(C)(C)CBr

InChIKey

CQWYAXCOVZKLHY-UHFFFAOYSA-N

InChI

InChI=1S/C5H11Br/c1-5(2,3)4-6/h4H2,1-3H3

Weigh it out

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

Names and synonyms

4 names

Propane, 1-bromo-2,2-dimethyl-
Neopentyl bromide
2,2-Dimethylpropyl bromide
2,2-Dimethyl-1-bromopropane

Work with 1-Bromo-2,2-dimethylpropane

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-Bromoisobutyl bromide594-34-347 % similar 2,2,4,4-Tetramethylpentane1070-87-740 % similar 1-Bromo-2,2-dimethoxypropane126-38-538 % similar 3-(Bromomethyl)-3-methyloxetane78385-26-938 % similar 2,2,4,6,6-Pentamethylheptane13475-82-637 % similar 2,2-Dimethylbutane75-83-235 % similar 2-Bromo-1,1,1-trifluoroethane421-06-733 % similar Neopentylamine5813-64-933 % 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 1-Bromopentane110-53-2 3-Bromopentane1809-10-5 2-Bromo-2-methylbutane507-36-8 (2S)-1-Bromo-2-methylbutane534-00-9

Elsewhere

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