1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate
Properties
- Molecular formula
- C21H33N3O4S
- Molar mass
- 423.57 g/mol
- Exact mass
- 423.2192 Da
- Melting point
- 113–115 °C
- logP
- 2.87Crippen estimate
- Polar surface area
- 91.2 Ų
- H-bond donors / acceptors
- 0 / 6
- Rotatable bonds
- 5
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.4% of notifiers
Aggregated from 39 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
2491-17-0SMILES
C[N+]1(CCN=C=NC2CCCCC2)CCOCC1.Cc1ccc(S(=O)(=O)[O-])cc1InChIKey
GBCAVSYHPPARHX-UHFFFAOYSA-MInChI
InChI=1S/C14H26N3O.C7H8O3S/c1-17(9-11-18-12-10-17)8-7-15-13-16-14-5-3-2-4-6-14;1-6-2-4-7(5-3-6)11(8,9)10/h14H,2-12H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
19 names · show all
- Morpholinium, 4-[2-[(cyclohexylcarbonimidoyl)amino]ethyl]-4-methyl-, 4-methylbenzenesulfonate (1:1)
- Morpholinium, 4-[2-[(cyclohexylimidocarbonyl)amino]ethyl]-4-methyl-, p-toluenesulfonate
- Morpholinium, 4-[2-[(cyclohexylcarbonimidoyl)amino]ethyl]-4-methyl-, salt with 4-methylbenzenesulfonic acid (1:1)
- 4-[2-[[(Cyclohexylimino)methylene]amino]ethyl]-4-methylmorpholinium p-toluenesulfonate
- N-Cyclohexyl-N′-β-(4-methylmorpholinium)ethylcarbodiimide p-toluenesulfonate
- N-Cyclohexyl-N′-[(N-methylmorpholinio)ethyl]carbodiimide p-toluenesulfonate
- CME-carbodiimide
- N-Cyclohexyl-N′-[β-(4-methylmorpholinio)ethyl]carbodiimide p-toluenesulfonate
- 1-Cyclohexyl-3-(2-morpholinyl-(4)-ethyl)carbodiimide metho-p-toluenesulfonate
- N-Cyclohexyl-N′-β-(4-methylmorpholinium)ethylcarbodiimide p-toluenesulfonate salt
- 1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide methyl-p-toluenesulfonate
- 1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulphonate
- N-Cyclohexyl-N-[β-(4-methylmorpholinium)ethyl] carbodiimide p-toluenesulfonate
- N-Cyclohexyl-N′-[β-(4-methylmorpholino)ethyl]carbodiimide p-toluenesulfonate
- 1-Cyclohexyl-3-(2-morpholinethyl)carbodiimide metho-p-toluenesulfonate
- CHM
- N-Cyclohexyl-N′-2-morpholinyl(4)ethylcarbodiimide methyl p-toluenesulfonate
- CMCT
- NSC 231596
Work with 1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
p-Toluenesulfonic acid monohydrate6192-52-5Hydrate
p-Toluenesulfonic acid104-15-4Free acid
Sodium p-toluenesulfonate657-84-1Salt
Pyridinium p-toluenesulfonate24057-28-1Salt
Collidinium P-toluenesulfonate59229-09-3Salt
Ferric p-toluenesulfonate77214-82-5Salt
Trump IR134127-48-3Salt
O-Benzylglycine toluene-p-sulphonate1738-76-7Salt
L-Alanine benzyl ester tosylate42854-62-6Salt
Valine benzyl ester 4-toluenesulfonate16652-76-9Salt
L-Aspartic acid dibenzyl ester tosylate2886-33-1Salt
L-Leucine benzyl ester p-toluenesulfonate1738-77-8Salt
Similar compounds
(R)-3-(P-Toluenesulfonyl) oxytetrahydrofuran219823-47-935 % similar
Triethylene glycol ditosylate19249-03-734 % similar
2,2′-Oxybis(ethyl tosylate)7460-82-434 % similar
N-Cyclohexyl-4-toluenesulfonamide80-30-832 % similar
1,3-Propanediol ditosylate5469-66-932 % similar
Ethylene glycol ditosylate6315-52-231 % similar
Cyclohexylmethyl tosyloxycarbamate869111-41-131 % similar
2-(2-(2-(2-Hydroxyethoxy)ethoxy)ethoxy)ethyl 4-methylbenzenesulfonate77544-60-631 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.