chempirical

4-(2-Chloroethyl)morpholine

C6H12ClNOCAS 3240-94-6149.62 g/mol

Open in Covalent MOL file
ClNO
Alkyl halideEtherTertiary amine

Properties

Molecular formula
C6H12ClNO
Molar mass
149.62 g/mol
Exact mass
149.0607 Da
Boiling point
93–94 °C (at 12 Torr)
logP
0.56Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
3240-94-6
SMILES
ClCCN1CCOCC1
InChIKey
ZAPMTSHEXFEPSD-UHFFFAOYSA-N
InChI
InChI=1S/C6H12ClNO/c7-1-2-8-3-5-9-6-4-8/h1-6H2

Weigh it out

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

Names and synonyms

11 names
  • Morpholine, 4-(2-chloroethyl)-
  • N-(2-Chloroethyl)morpholine
  • Morpholinoethyl chloride
  • β-Morpholinoethyl chloride
  • 2-Morpholinoethyl chloride
  • 2-Morpholino-1-chloroethane
  • β-Chloroethylmorpholine
  • 1-Chloro-2-morpholinoethane
  • 2-(4-Morpholinyl)ethyl chloride
  • 1-Morpholino-2-chloroethane
  • N-(Chloroethyl)morpholine

Work with 4-(2-Chloroethyl)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

4-(2-Chloroethyl)morpholine hydrochloride3647-69-685 % similar 4-(3-Chloropropyl)morpholine7357-67-771 % similar Dimorpholinodiethyl ether6425-39-465 % similar 4-(3-Chloropropyl)morpholine hydrochloride57616-74-763 % similar 2.2.2-Cryptand23978-09-861 % similar 1-(2-Chloroethyl)piperidine1932-03-252 % similar Dimorpholinomethane5625-90-150 % similar 4-Morpholineethanamine2038-03-148 % similar

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

Same formula

2-Cyclopentene-1-methanol, 4-amino-, hydrochloride (1:1), (1S,4R)-168960-19-8 Chloro-N,N-diethylacetamide2315-36-8

Elsewhere

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