chempirical

Hexamethylene bisacetamide

C10H20N2O2CAS 3073-59-4200.28 g/mol

Open in Covalent MOL file
ONHNHO

Properties

Molecular formula
C10H20N2O2
Molar mass
200.28 g/mol
Exact mass
200.1525 Da
Melting point
125 °C
Boiling point
208 °C (at 0.3 Torr)
logP
2.50Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
3073-59-4
SMILES
CC(O)=NCCCCCCN=C(C)O
InChIKey
BNQSTAOJRULKNX-UHFFFAOYSA-N
InChI
InChI=1S/C10H20N2O2/c1-9(13)11-7-5-3-4-6-8-12-10(2)14/h3-8H2,1-2H3,(H,11,13)(H,12,14)

Weigh it out

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

Names and synonyms

10 names
  • Acetamide, N,N′-1,6-hexanediylbis-
  • Acetamide, N,N′-hexamethylenebis-
  • N,N′-1,6-Hexanediylbis[acetamide]
  • Hexamethylenediacetamide
  • N,N′-Diacetylhexamethylenediamine
  • N,N′-Hexamethylenebisacetamide
  • DADH
  • HMBA
  • NSC 95580
  • 1,6-Hexanebisacetoacetamide

Work with Hexamethylene bisacetamide

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

N,N'-Diacetylethylenediamine871-78-374 % similar 6-Acetylaminocaproic acid57-08-967 % similar N-(2-Hydroxyethyl)acetamide142-26-761 % similar 4-Acetamidobutyric acid3025-96-559 % similar N-(2-Chloroethyl)acetamide7355-58-058 % similar Ethylacetamide625-50-352 % similar N-(Hydroxymethyl)acetamide625-51-452 % similar N-Acetyl-beta-alanine3025-95-452 % similar

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

Same formula

tert-Butyl n-((1r,3r)-3-aminocyclopentyl)carbamate1009075-44-8 tert-Butyl3-((methylamino)methyl)azetidine-1-carboxylate1049730-81-5 3-(N-Boc-methylaminomethyl)azetidine1053655-53-0 tert-Butyl 1,4-diazepane-1-carboxylate112275-50-0 (S)-1-N-Boc-2-(aminomethyl)pyrrolidine119020-01-8 tert-Butyl 3-methylpiperazine-1-carboxylate120737-59-9 tert-Butyl 2-methylpiperazine-1-carboxylate120737-78-2 1-Boc-3-aminopiperidine144243-24-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook