chempirical

1,16-Dibromohexadecane

C16H32Br2CAS 45223-18-5384.24 g/mol

Open in Covalent MOL file
BrBr
Alkyl halide

Properties

Molecular formula
C16H32Br2
Molar mass
384.24 g/mol
Exact mass
382.0871 Da
logP
7.24Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
15

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
45223-18-5
SMILES
C(CCCCCCCCBr)CCCCCCCBr
InChIKey
OTFBUFWEFKVFFR-UHFFFAOYSA-N
InChI
InChI=1S/C16H32Br2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h1-16H2

Weigh it out

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Work with 1,16-Dibromohexadecane

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,5-Dibromopentane111-24-0100 % similar 1,11-Dibromoundecane16696-65-4100 % similar 1,12-Dibromododecane3344-70-5100 % similar 1,10-Dibromodecane4101-68-2100 % similar 1,7-Dibromoheptane4549-31-9100 % similar 1,8-Dibromooctane4549-32-0100 % similar 1,9-Dibromononane4549-33-1100 % similar 1,6-Dibromohexane629-03-8100 % similar

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

Elsewhere

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