N,N'-Diacetylethylenediamine

C6H12N2O2CAS 871-78-3144.17 g/mol

Open in Covalent MOL file
ONHNHO

Properties

Molecular formula
C6H12N2O2
Molar mass
144.17 g/mol
Exact mass
144.0899 Da
Melting point
175 °C
Boiling point
200 °C (at 2.5 Torr)
logP
0.94Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
871-78-3
SMILES
CC(O)=NCCN=C(C)O
InChIKey
WNYIBZHOMJZDKN-UHFFFAOYSA-N
InChI
InChI=1S/C6H12N2O2/c1-5(9)7-3-4-8-6(2)10/h3-4H2,1-2H3,(H,7,9)(H,8,10)

Weigh it out

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

Names and synonyms

12 names
  • N,N′-Diacetylethylenediamine
  • Acetamide, N,N′-1,2-ethanediylbis-
  • Acetamide, N,N′-ethylenebis-
  • N,N′-1,2-Ethanediylbis[acetamide]
  • 1,2-Ethanediamine, N,N′-diacetyl-
  • N,N′-Ethylenebisacetamide
  • Diacetylethylenediamine
  • 1,2-Diacetamidoethane
  • N-[2-(Acetylamino)ethylene]acetamide
  • NSC 603
  • 1,2-Ethylene bisacetamide
  • 1,2-Bis(acetylamino)ethane

Work with N,N'-Diacetylethylenediamine

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

Hexamethylene bisacetamide3073-59-474 % similar N-(2-Hydroxyethyl)acetamide142-26-770 % similar N-(2-Chloroethyl)acetamide7355-58-067 % similar Ethylacetamide625-50-360 % similar N-(Hydroxymethyl)acetamide625-51-460 % similar N-Acetyl-beta-alanine3025-95-458 % similar 4-Acetamidobutyric acid3025-96-554 % similar N-(2-Phenylethyl)acetamide877-95-254 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(Piperazin-1-yl)-acetic acid H2O37478-58-3 Methyl piperazine-1-carboxylate50606-31-0 N1,N2-Diethylethanediamide615-84-9 Adipamide628-94-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook