chempirical

1,4-Piperazinediethanol

C8H18N2O2CAS 122-96-3174.24 g/mol

Open in Covalent MOL file
HONNOH
AlcoholTertiary amine

Properties

Molecular formula
C8H18N2O2
Molar mass
174.24 g/mol
Exact mass
174.1368 Da
Melting point
134–135 °C
Boiling point
215–220 °C (at 50 Torr)
logP
-1.41Crippen estimate
Polar surface area
46.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4

Identifiers

CAS number
122-96-3
SMILES
OCCN1CCN(CCO)CC1
InChIKey
VARKIGWTYBUWNT-UHFFFAOYSA-N
InChI
InChI=1S/C8H18N2O2/c11-7-5-9-1-2-10(4-3-9)6-8-12/h11-12H,1-8H2

Weigh it out

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

Names and synonyms

13 names · show all
  • N,N′-Bis(β-hydroxyethyl)piperazine
  • 1,4-Bis(2-hydroxyethyl)piperazine
  • N,N′-Di(2-hydroxyethyl)piperazine
  • 1,4-Di(2-hydroxyethyl)piperazine
  • 1,4-Bis(β-hydroxyethyl)piperazine
  • N,N′-Bis(2-hydroxyethyl)piperazine
  • NSC 26892
  • NSC 31268
  • NSC 36645
  • 1,4-Bis(hydroxyethyl)piperazine
  • 2,2′-(Piperazine-1,4-diyl)diethanol
  • 2-[4-(2-Hydroxyethyl)piperazin-1-yl]ethan-1-ol
  • 2-[4-(2-Hydroxyethyl)piperazin-1-yl]ethanol

Work with 1,4-Piperazinediethanol

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-Aziridineethanol1072-52-2100 % similar N,N,N′,N′-Tetrakis(2-hydroxyethyl)ethylenediamine140-07-8100 % similar Triethanolamine102-71-692 % similar 1-Pyrrolidineethanol2955-88-673 % similar Triethanolamine hydrochloride637-39-873 % similar 1-Piperidineethanol3040-44-669 % similar Hexahydro-1,3,5-tris(2-hydroxyethyl)-S-triazine4719-04-467 % similar 4-Methyl-1-piperazineethanol5464-12-067 % similar

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

Same formula

N-Boc-N-methylethylenediamine121492-06-6 N-(tert-Butoxycarbonyl)-N'-methylethylenediamine122734-32-1 1-[2-(2-Hydroxyethoxy)ethyl]piperazine13349-82-1 1,1-Dimethylethyl 2-(1-methylethyl)hydrazinecarboxylate16689-35-3 tert-Butyl (3-aminopropyl)carbamate75178-96-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook