1-Propanaminium, 3,3',3''-[phosphinylidynetris(oxy)]tris[N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N',N''-tri-C6-18 acyl derivs. trichlorides structure

3D Mol Similar

1-Propanaminium, 3,3',3''-[phosphinylidynetris(oxy)]tris[N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N',N''-tri-C6-18 acyl derivs. trichlorides

: Iupac Name：[3-bis[3-[dimethyl-[3-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]propyl]azaniumyl]-2-hydroxypropoxy]phosphoryloxy-2-hydroxypropyl]-dimethyl-[3-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]propyl]azanium;trichloride; CAS No.: 83682-78-4; Molecular Weight：1469.392561; Modify Date.: 2022-10-30 22:35

Request For Quotation

1. Names and Identifiers

: 1.1 Name; 1-Propanaminium, 3,3',3''-[phosphinylidynetris(oxy)]tris[N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N',N''-tri-C6-18 acyl derivs. trichlorides; 1.2 Synonyms; 1-Propanaminium, 3,3,3-phosphinylidynetris(oxy)trisN-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N,N-tri-C6-18 acyl derivs. trichlorides 1-Propanaminium, 3,3′,3′′-(Phosphinylidintris(oxy))tris(N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N′,N′′-Tri-C6-18-acylderivate, Trichloride 1-Propanaminium, 3,3′,3′′-[phosphinylidynetris(oxy)]tris[N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-, N,N′,N′′-tri-C6-18 acyl derivs. trichlorides 3,3',3''-[Phosphinylidynetris(oxy)]tris[N-(3-aminopropyl)-2-hydroxy-N,N-dimethyl-1-propanaminium N,N',N''-tricocoyl derivs. trichlorides Cocamidopropyl PG-Dimonium Chloride Phosphate Einecs 280-518-3 Tris(N-C5-17-alkylamidopropyl-N,N-dimethyl-N-(2-hydroxypropyl)ammonio) phosphate trichloride; View all

1.3 CAS No.: 83682-78-4

1.4 CID: 71587308

1.5 EINECS(EC#): 280-518-3

1.6 Molecular Formula: C78H150Cl3N6O10P (isomer)

1.7 Inchi: InChI=1S/C78H147N6O10P.3ClH/c1-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-58-76(88)79-61-55-64-82(4,5)67-73(85)70-92-95(91,93-71-74(86)68-83(6,7)65-56-62-80-77(89)59-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-2)94-72-75(87)69-84(8,9)66-57-63-81-78(90)60-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-3;;;/h22-27,31-36,73-75,85-87H,10-21,28-30,37-72H2,1-9H3;3*1H/b25-22-,26-23-,27-24-,34-31-,35-32-,36-33-;;;

1.8 InChIkey: ISRLGZXSKRDKID-JXBDSQKUSA-N

1.9 Canonical Smiles: CCCCCC=CCC=CCCCCCCCC(=O)NCCC[N+](C)(C)CC(COP(=O)(OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCC=CCC=CCCCCC)O)OCC(C[N+](C)(C)CCCNC(=O)CCCCCCCC=CCC=CCCCCC)O)O.[Cl-].[Cl-].[Cl-]

1.10 Isomers Smiles: CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCCC[N+](CC(O)COP(=O)(OCC(O)C[N+](CCCNC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(C)C)OCC(O)C[N+](CCCNC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(C)C)(C)C.[Cl-].[Cl-].[Cl-]

2. Computational chemical data

Molecular Weight: 1469.392561g/mol
Molecular Formula: C₇₈H₁₅₀Cl₃N₆O₁₀P
Compound Is Canonicalized: True
XLogP3-AA: null
Exact Mass: 1467.021665
Monoisotopic Mass: 1467.021665
Complexity: 1840
Rotatable Bond Count: 69
Hydrogen Bond Donor Count: 6
Hydrogen Bond Acceptor Count: 13
Topological Polar Surface Area: 193
Heavy Atom Count: 98
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 3
Defined Bond Stereocenter Count: 6
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 4
CACTVS Substructure Key Fingerprint: AAADcfB/vAIGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCCAACBThgAYCAAPAAxCIQCFSEIAAAAAgAAAICIEIAAgDEBIAwQAEAAAClgCZAAMYiICAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

3. Recommended Suppliers

Global7SuppliersView all >>

Baoji Guokang Healthchem co.,ltd Diamond member

1YR

Products:API',s intermediates,fine chemicals and plant extracts.
Tel:86-917-3909592
Email:gksales1@gk-bio.com

cocamidopropyl propylene glycol phosphate dimethyl ammonium chloride

Purity:99%Packing: 200kg/bag FOB
Price: 0 USD/kg
Time: 2024/11/15

Inquire

Amitychem Corporation Diamond member

4YRS

Products:Manufacture & Supply Biopharm Chemical, Specialty Chemical, PetroChemical.
Tel:86-592-8883942
Email:sale@amitychem.com

Factory Supply Cocamidopropyl PG-Dimonium Chloride Phosphate

Purity:99%Packing: 200kg/bag FOB
Price: 0.1 USD/kilogram
Time: 2023/06/28

Inquire

Alfa Chemistry Diamond member

2YRS

Products:Nanomaterials, Catalysts, Active Pharmaceutical Ingredients, Protection Reagents, Boronic Compounds, Fluorophores, Dyes, reagents, Insect Pheromone, Ionic Liquids, Lipids, Material &, Chemicals
Tel:1516-734-6573
Email:support@alfa-chemistry.com

Cocamidopropyl PG-Dimonium

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2024/09/23

Inquire

Shinnov Korea Audited Suppliers

Products:Concrete Superplasticizer(PCE),Concrete admixture additives,Cement, Mortar additives,Anionic Surfactants,Amphoteric Surfactants, Cationic Surfactants,Nonionic Surfactants
Tel:82-070-82110226

Cocamidopropyl PG-dimonium Chloride Phosphate,CDP-W， CDP-45Cocamidopropyl PG-dimonium Chloride Phosphate, Mild Surfactant, Conditioning Agent.

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2024/10/24

Inquire

M.C.Biotec Inc.

Tel:+86-(25)-86620042

Linolemidopropyl PG-Dimonium Chloride Phosphate

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2010/11/13

Inquire

4. Realated Product Infomation

197179-61-6 [Phosphinyldyne tris(oxy)] tris[3-aminopropyl-2-hydroxy-N,N-dimethyl 1-N -alkyl(C=6～18) trichlorides

68648-46-4 Benzenemethanaminium, N-(3-aminopropyl)-N,N-dimethyl-, N-tallow acyl derivs., chlorides

61789-70-6 Benzenemethanaminium, N-(3-aminopropyl)-N,N-dimethyl-, N-coco acyl derivs., chlorides

72102-40-0 1-Propanaminium, 3-amino-N-ethyl-N,N-dimethyl-, N-lanolin acyl derivs., Et sulfates

91783-17-4 1-Propanaminium,3-amino-N-(carboxymethyl)-N,N-dimethyl-, N-tallow acyl derivs., inner salts

113492-03-8 1-Propanaminium, 3-amino-N-ethyl-N,N-dimethyl-, N-coco acyl derivs., Et sulfates

68607-25-0 1-Propanaminium, 3-amino-N-(carboxymethyl)-N,N-dimethyl-, N-coco acyl derivs., hydroxides, sodium salts

Recently Updated : 1566722-26-6 1565025-23-1 1564889-53-7 1566621-11-1 1566247-71-9 1566157-97-8 1566246-39-6 1564860-12-3 1565492-22-9 1566156-49-7