chempirical

2,3-Dibromosuccinic acid

C4H4Br2O4CAS 526-78-3275.88 g/mol

Open in Covalent MOL file
OHOBrBrOOH
Alkyl halideCarboxylic acid

Properties

Molecular formula
C4H4Br2O4
Molar mass
275.88 g/mol
Exact mass
273.8476 Da
Melting point
167 °C
logP
0.68Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Hazards

Danger
Corrosive (GHS05)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
526-78-3
SMILES
O=C(O)C(Br)C(Br)C(=O)O
InChIKey
FJWGRXKOBIVTFA-UHFFFAOYSA-N
InChI
InChI=1S/C4H4Br2O4/c5-1(3(7)8)2(6)4(9)10/h1-2H,(H,7,8)(H,9,10)

Weigh it out

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

Names and synonyms

7 names
  • Butanedioic acid, 2,3-dibromo-
  • Succinic acid, 2,3-dibromo-
  • Succinic acid, α,β-dibromo-
  • 2,3-Dibromobutanedioic acid
  • α,β-Dibromosuccinic acid
  • NSC 119053
  • NSC 1904

Reactions

Work with 2,3-Dibromosuccinic acid

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

(2S)-2-Bromo-3-methylbutanoic acid26782-75-267 % similar 2,3-Dibromobutanoic acid600-30-664 % similar 1,2,3,4,5,6-Cyclohexanehexacarboxylic acid2216-84-450 % similar (2S)-2-Bromopropanoic acid32644-15-850 % similar Bromochloroacetic acid5589-96-850 % similar 2-Bromopropionic acid598-72-150 % similar 2,3-Dibromo-3-phenylpropanoic acid6286-30-250 % similar 2,3-Dibromopropionic acid600-05-546 % similar

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

Same formula

Rel-(2R,3S)-2,3-dibromobutanedioic acid608-36-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook