chempirical

2.2.2-Cryptand

C18H36N2O6CAS 23978-09-8376.49 g/mol

Open in Covalent MOL file
ONOONOOO
EtherTertiary amine

Properties

Molecular formula
C18H36N2O6
Molar mass
376.49 g/mol
Exact mass
376.2573 Da
logP
-0.28Crippen estimate
Polar surface area
61.9 Ų
H-bond donors / acceptors
0 / 8
Rotatable bonds
0

Identifiers

CAS number
23978-09-8
SMILES
C1COCCN2CCOCCOCCN(CCO1)CCOCCOCC2
InChIKey
AUFVJZSDSXXFOI-UHFFFAOYSA-N
InChI
InChI=1S/C18H36N2O6/c1-7-21-13-14-24-10-4-20-5-11-25-17-15-22-8-2-19(1)3-9-23-16-18-26-12-6-20/h1-18H2

Weigh it out

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

Names and synonyms

17 names · show all
  • 4,7,13,16,21,24-Hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane
  • Cryptating agent 222
  • Kryptofix 222
  • Cryptand 222
  • Cryptate 222
  • 2,2,2-Cryptand
  • 2,2,2-Crypt
  • Cryptand C 222
  • Cryptofix 222
  • 2,2,2-Cryptate
  • Crypt-2,2,2
  • Kryptand 222
  • NSC 264495
  • K 222
  • [2,2,2]Crypand
  • Cryptand[2.2.2]
  • WS-A 101

Work with 2.2.2-Cryptand

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

Dimorpholinodiethyl ether6425-39-492 % similar Dimorpholinomethane5625-90-167 % similar 2-(2-Methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine70384-51-967 % similar 4-Morpholineethanamine2038-03-161 % similar 4-(2-Chloroethyl)morpholine3240-94-661 % similar 4-Morpholineethanol622-40-261 % similar N-(2-Dimethylaminoethyl)morpholine4385-05-158 % similar Ethylmorpholine100-74-356 % similar

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

Elsewhere

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