chempirical

4-(Chloroacetyl)morpholine

C6H10ClNO2CAS 1440-61-5163.60 g/mol

Open in Covalent MOL file
OClNO
Alkyl halideAmideEther

Properties

Molecular formula
C6H10ClNO2
Molar mass
163.60 g/mol
Exact mass
163.0400 Da
Density
1.2782 g/mL (at 20 °C)
Boiling point
152–160 °C (at 6 Torr)
logP
0.08Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
1440-61-5
SMILES
O=C(CCl)N1CCOCC1
InChIKey
YMQRPXBBBOXHNZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H10ClNO2/c7-5-6(9)8-1-3-10-4-2-8/h1-5H2

Weigh it out

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

Names and synonyms

14 names · show all
  • Ethanone, 2-chloro-1-(4-morpholinyl)-
  • Morpholine, 4-(chloroacetyl)-
  • 2-Chloro-1-(4-morpholinyl)ethanone
  • N-(Chloroacetyl)morpholine
  • Chloroacetic acid morpholide
  • 4-Morpholinylcarbonylmethyl chloride
  • 4-(2-Chloroacetyl)morpholine
  • 2-Morpholino-2-oxoethyl chloride
  • 2-Chloro-1-morpholino-1-ethanone
  • Chloroacetic acid morpholine amide
  • 2-Chloro-1-(morpholin-4-yl)ethanone
  • NSC 54542
  • 2-Chloro-1-morpholinoethanone
  • 2-Chloro-1-(morpholin-4-yl)ethan-1-one

Work with 4-(Chloroacetyl)morpholine

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

2-Chloro-1-(1-pyrrolidinyl)ethanone20266-00-663 % similar 2-Chloro-1-(1-piperidinyl)ethanone1440-60-460 % similar 4-(Cyanoacetyl)morpholine15029-32-053 % similar 2-Amino-1-(morpholin-4-yl)ethanone hydrochloride24152-96-353 % similar 4-Morpholinecarbonyl chloride15159-40-752 % similar 4-(1-Piperazinylacetyl)morpholine39890-46-550 % similar Chloro-N,N-diethylacetamide2315-36-848 % similar N-Acetylmorpholine1696-20-446 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook