chempirical

Bis-tris propane

C11H26N2O6CAS 64431-96-5282.34 g/mol

Open in Covalent MOL file
HOHOHONHNHHOHOOH
AlcoholSecondary amine

Properties

Molecular formula
C11H26N2O6
Molar mass
282.34 g/mol
Exact mass
282.1791 Da
logP
-4.01Crippen estimate
Polar surface area
145.4 Ų
H-bond donors / acceptors
8 / 8
Rotatable bonds
12

Identifiers

CAS number
64431-96-5
SMILES
OCC(CO)(CO)NCCCNC(CO)(CO)CO
InChIKey
HHKZCCWKTZRCCL-UHFFFAOYSA-N
InChI
InChI=1S/C11H26N2O6/c14-4-10(5-15,6-16)12-2-1-3-13-11(7-17,8-18)9-19/h12-19H,1-9H2

Weigh it out

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

Names and synonyms

7 names
  • 1,3-Propanediol, 2,2′-(1,3-propanediyldiimino)bis[2-(hydroxymethyl)-
  • 2,2′-(1,3-Propanediyldiimino)bis[2-(hydroxymethyl)-1,3-propanediol]
  • 1,3-Bis[tris(hydroxymethyl)methylamino]propane
  • BTP
  • NSC 610927
  • 1,3-Bis[1,1-bis(hydroxymethyl)-2-hydroxyethylamino]propane
  • 2-[3-[[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]propylamino]-2-(hydroxymethyl)propane-1,3-diol

Work with Bis-tris propane

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

Taps (buffer)29915-38-656 % similar Tes (buffer)7365-44-848 % similar Tricine5704-04-142 % similar Ethanesulfonic acid, 2-[[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]amino]-, sodium salt (1:1)70331-82-742 % similar Tapso68399-81-532 % similar Pentaerythritol115-77-532 % similar

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

Elsewhere

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