Bromoacetic acid N-hydroxysuccinimide ester

C₆H₆BrNO₄CAS 42014-51-7236.02 g/mol

Open in Covalent MOL file

Alkyl halide Amide Lactam

Properties

Molecular formula: C₆H₆BrNO₄
Molar mass: 236.02 g/mol
Exact mass: 234.9480 Da
logP: -0.01Crippen estimate
Polar surface area: 63.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

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

42014-51-7

SMILES

C1CC(=O)N(C1=O)OC(=O)CBr

InChIKey

NKUZQMZWTZAPSN-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrNO4/c7-3-6(11)12-8-4(9)1-2-5(8)10/h1-3H2

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Names and synonyms

1 names

N-Succinimidyl bromoacetate

Work with Bromoacetic acid N-hydroxysuccinimide ester

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

Disuccinimidyl glutarate79642-50-564 % similar Disuccinimidyl suberate68528-80-359 % similar Iodoacetic acid N-hydroxysuccinimide ester39028-27-857 % similar Bis-pe21- nhs ester1008402-79-655 % similar 3,3′-Dithiobis(succinimidyl propionate)57757-57-055 % similar Bis(nhs)peg5756526-03-155 % similar 2,5-Dioxopyrrolidin-1-yl 2-cyanoacetate56657-76-252 % similar N-Hydroxysuccinimide S-acetylthioacetate76931-93-652 % similar

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

Elsewhere

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