chempirical

Sodium triacetoxyborohydride

C6H10BNaO6CAS 56553-60-7211.94 g/mol

Open in Covalent MOL file
OOBH−OOOONa+

Properties

Molecular formula
C6H10BNaO6
Molar mass
211.94 g/mol
Exact mass
212.0468 Da
logP
-3.60Crippen estimate
Polar surface area
78.9 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
3

Identifiers

CAS number
56553-60-7
SMILES
CC(=O)O[BH-](OC(C)=O)OC(C)=O.[Na+]
InChIKey
HHYFEYBWNZJVFQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H10BO6.Na/c1-4(8)11-7(12-5(2)9)13-6(3)10;/h7H,1-3H3;/q-1;+1

Weigh it out

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

Names and synonyms

7 names
  • Borate(1-), tris(acetato-κO)hydro-, sodium (1:1), (T-4)-
  • Borate(1-), tris(acetato-O)hydro-, sodium, (T-4)-
  • Borate(1-), tris(acetato-κO)hydro-, sodium, (T-4)-
  • Hydride, boron complex
  • Sodium triacetoxy(hydro)borate
  • Sodium triacetatohydroborate
  • Sodium borohydride acetate

Work with Sodium triacetoxyborohydride

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

Acetic anhydride108-24-745 % similar Tetraacetoxysilane562-90-339 % similar Methyl acetate79-20-939 % similar 1,8-Diacetoxy-3,6-dioxaoctane111-21-738 % similar Oxydiethylene acetate628-68-238 % similar Glycol diacetate111-55-738 % similar Peracetic acid79-21-038 % similar Dimethyldiacetoxysilane2182-66-336 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia