Products Categories
| CAS No.: | 14492-68-3 |
|---|---|
| Name: | 1-[2-Oxo-2-[[2-[(1-oxooctadecyl)oxy]ethyl]amino]ethyl]pyridinium chloride |
| Molecular Structure: | |
|
|
|
| Formula: | C27H47ClN2O3 |
| Molecular Weight: | 483.13 |
| Synonyms: | Pyridinium,1-[2-oxo-2-[[2-[(1-oxooctadecyl)oxy]ethyl]amino]ethyl]-, chloride (9CI);Pyridinium, 1-[[(2-hydroxyethyl)carbamoyl]methyl]-, chloride, stearate (8CI);1-[2-Oxo-2-[[2-[(1-oxooctadecyl)oxy]ethyl]amino]ethyl]pyridinium chloride;Emcol E 607S;N-[[N-(2-Stearoyloxyethyl)carbamoyl]methyl]pyridinium chloride;Quaternium 7;Stearoyl colaminoformylmethylpyridiniumchloride; |
| EINECS: | 238-501-3 |
| Appearance: | COA |
| PSA: | 59.28000 |
| LogP: | 3.28990 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 211914-50-0N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride
- 1450881-55-6SAR-20347
- 145100-50-12-[N,N-BIS(TRIFLUOROMETHYLSULFONYL)AMINO]PYRIDINE
- 14513-43-03,3''-(1-METHYLETHYLIDENE)BIS-7-OXABICYCLO[4.1.0]HEPTANE
- 14515-69-6Cobalt, hexacarbonyl[m-[1,1'-(h2:h2-1,2-ethynediyl)bis[benzene]]]di-, (Co-Co)
- 1451-83-82-bromo-3-methylpropiophenone
- 14518-69-5TETRABUTYLPHOSPHONIUM HYDROXIDE
- 1452-15-94-CYANOTHIAZOLE
- 145222-00-01-(2-CHLORO-ACETYL)-PIPERAZINE HCL
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
What can I do for you?
Get Best Price
Specification
The systematic name of Steapyrium chloride is 1-(2-{[2-(octadecanoyloxy)ethyl]amino}-2-oxoethyl)pyridinium chloride. With the CAS registry number 14492-68-3, it is also named as 1-[2-Oxo-2-[[2-[(1-oxooctadecyl)oxy]ethyl]amino]ethyl]pyridinium chloride. In addition, its molecular formula is C27H47N2O3.Cl and molecular weight is 483.13.
The other characteristics of Steapyrium chloride can be summarized as: (1)ACD/LogP: 4.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.05; (4)ACD/LogD (pH 7.4): 4.05; (5)ACD/BCF (pH 5.5): 707.74; (6)ACD/BCF (pH 7.4): 707.76; (7)ACD/KOC (pH 5.5): 3815.41; (8)ACD/KOC (pH 7.4): 3815.52; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 22; (12)Polar Surface Area: 50.49 Å2; (13)EINECS: 238-501-3.
People can use the following data to convert to the molecule structure.
(1)SMILES: [Cl-].O=C(NCCOC(=O)CCCCCCCCCCCCCCCCC)C[n+]1ccccc1
(2)InChI: InChI=1/C27H46N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-27(31)32-24-21-28-26(30)25-29-22-18-16-19-23-29;/h16,18-19,22-23H,2-15,17,20-21,24-25H2,1H3;1H
(3)InChIKey: LNEXUGPWTFNCSO-UHFFFAOYAQ
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 56mg/kg (56mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00178, |