[Bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid

Base Information

• Chemical Name: [Bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid
• CAS No.: 34690-00-1
• Deprecated CAS: 120718-90-3
• Molecular Formula: C17H44N3O15P5
• Molecular Weight: 685.416
• European Community (EC) Number: 252-156-6,252-656-4
• UNII: PHO21X9SHC
• DSSTox Substance ID: DTXSID9029358
• Nikkaji Number: J250.953I
• Wikidata: Q27286560
• Mol file: 34690-00-1.mol

Synonyms:34690-00-1;[bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid;BHMTPMPA;35657-77-3;UNII-PHO21X9SHC;PHO21X9SHC;EINECS 252-156-6;Bishexamethylenetriamine, pentamethylenepentaphosphonic acid;EC 252-156-6;Phosphonic acid, (((phosphonomethyl)imino)bis(6,1-hexanediylnitrilobis(methylene)))tetrakis-;P,P',P'',P'''-(((Phosphonomethyl)imino)bis(6,1-hexanediylnitrilobis(methylene)))tetrakisphosphonic acid;Phosphonic acid, P,P',P'',P'''-(((phosphonomethyl)imino)bis(6,1-hexanediylnitrilobis(methylene)))tetrakis-;(((Phosphonomethyl)imino)bis(6,1-hexanediylnitrilobis(methylene)))tetrakisphosphonic acid;[[(Phosphonomethyl)imino]bis[hexamethylenenitrilobis(methylene)]]tetrakisphosphonic acid;Phosphonic acid, [[(phosphonomethyl)imino]bis[6,1-hexanediylnitrilobis(methylene)]]tetrakis-;Bis(hexamethylenetriaminepenta(methylenephosphonic acid));(((Phosphonomethyl)imino)bis(hexamethylenenitrilobis(methylene)))tetrakisphosphonic acid;[[(Phosphonomethyl)imino]bis[6,1-hexanediylnitrilobis(methylene)]]tetrakisphosphonic acid;C17H44N3O15P5;BHTPMP;Phosphonic acid, [[(phosphonomethyl)imino]bis[6,1-hexanediylnitrilobis(methylene)]]tetrakis-, sodium salt;SCHEMBL22601;BRIQUEST 5123-45A;DTXSID9029358;AKOS015918405;C17-H44-N3-O15-P5;FT-0659632;A822348;W-110850;Q27286560;(DIHEXYLTRIAMINEPENTA(METHYLENEPHOSPHONIC ACID));Bis(hexamethylene triamine penta(methylene phosphonic acid));TRIAMINODIHEXYLENEPENTAKIS(METHYLENEPHOSPHONIC ACID);Bis(Hexamethylene Triamine Penta (Methylene Phosphonic Acid));BIS(HEXAMETHYLENE)TRIAMINE-PENTAKIS(METHYLPHOSPHONICACID);BIS(HEXAMETHYLENETRIAMINE)PENTA(METHYLENEPHOSPHONIC ACID);DIHEXAMETHYLENETRIAMINEPENTAKIS(METHYLENEPHOSPHONIC ACID);N,N-Bis[6-[bis(phosphonomethyl)amino]hexyl]phosphonomethanamine;Bis(Hexamethylene Triamine Penta(Methylenephosphonic Acid));BHMT;[(bis{6-[bis(phosphonomethyl)amino]hexyl}amino)methyl]phosphonic acid;[[(Phosphonomethyl)imino]bis[6,1-hexanediylnitrilobis(methylene)]]tetrakis-phosphonic acid;N-(6-AMINOHEXYL)-1,6-HEXANEDIAMINE PENTA (METHYLENE PHOSPHONIC ACID);Phosphonic acid, [[(phosphonomethyl)imino] bis[6,1-hexanediylnitrilobis(methylene)]]tetrakis -

Chemical Property of [Bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid

Chemical Property:

• Appearance/Colour: Dark brown liquid
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.578
• Boiling Point: 1002.7 °C at 760 mmHg
• PKA: 0.70±0.10(Predicted)
• Flash Point: 560.2 °C
• PSA: 346.42000
• Density: 1.606 g/cm³
• LogP: 0.68920
• Water Solubility.: 550g/L at 20℃
• XLogP3: -12.3
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 24
• Exact Mass: 685.14605269
• Heavy Atom Count: 40
• Complexity: 846

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(CCCN(CP(=O)(O)O)CP(=O)(O)O)CCN(CCCCCCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O

Technology Process of [Bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid

There total 2 articles about [Bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + C12H29N3*ClH → {[(Phosphonomethyl)imino]bis[hexamethylenenitrilobis(methylene)]}tetrakisphosphonic acid (34690-00-1)

Guidance literature:

With phosphonic Acid; at 80 ℃; for 8h; Temperature;

Reference yield:

→ {[(Phosphonomethyl)imino]bis[hexamethylenenitrilobis(methylene)]}tetrakisphosphonic acid (34690-00-1)

Guidance literature:

Orthophosphorigersaeure, 1)Bishexamethylentriamin 2)Paraformaldehyd;

upstream raw materials:

formaldehyd

Refernces