Arcaine sulfate

Base Information

• Chemical Name: Arcaine sulfate
• CAS No.: 14923-17-2
• Molecular Formula: C6H18N6O4S
• Molecular Weight: 270.31
• Hs Code.: 2925290090
• European Community (EC) Number: 253-118-1
• DSSTox Substance ID: DTXSID80872308
• ChEMBL ID: CHEMBL1256017
• Mol file: 14923-17-2.mol

Synonyms:Arcaine sulfate;14923-17-2;36587-93-6;Arcaine sulfate salt;Arcaine (sulfate);2-[4-(diaminomethylideneamino)butyl]guanidine;sulfuric acid;1,4-Diguanidinobutane sulfate;Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1);EINECS 253-118-1;1,1'-Tetramethylenediguanidine sulphate;NCGC00093576-02;1,1'-(Butane-1,4-diyl)diguanidine sulfate;1,4-Diguanidinobutane sulfate salt;SR-01000075422;MFCD00050545;C6H16N6.H2O4S;Prestwick_1059;ARCAINE SULPHATE;DSSTox_CID_28664;DSSTox_RID_82934;DSSTox_GSID_48738;C6H16N6.xH2O4S;SPECTRUM1500706;SCHEMBL1999196;C6H16N6.H2SO4;CHEMBL1256017;HMS501B17;DTXSID80872308;HMS1570P13;HMS2097P13;HMS3260M05;Tox21_113186;Tox21_500062;CCG-38521;HB0118;AKOS028109560;AKOS030228005;C6-H16-N6.H2-O4-S;C6-H16-N6.x-H2-O4-S;1,1'-Tetramethylenediguanidine sulfate;LP00062;N,N'-1,4-Butanediylbisguanidine sulfate;NCGC00093576-01;NCGC00093576-03;NCGC00093576-04;NCGC00260747-01;AS-68651;1,1'-(Butane-1,4-diyl)diguanidinesulfate;1,1-(Butane-1,4-diyl)diguanidine sulfate;CAS-36587-93-6;N,N'-1,4-Butanediylbis(guanidine) sulfate;A-285;EU-0100062;FT-0622466;A 0384;N-(4-carbamimidamidobutyl)guanidine;SR-01000075422-1;SR-01000075422-3;SR-01000075422-5;sulfuric acid.;Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1) (9CI);N''-{4-[(DIAMINOMETHYLIDENE)AMINO]BUTYL}GUANIDINE;SULFURIC ACID

Chemical Property of Arcaine sulfate

Chemical Property:

• Vapor Pressure: 6.76E-07mmHg at 25°C
• Melting Point: 291°C (dec.)
• Boiling Point: 408.9°Cat760mmHg
• Flash Point: 201.1°C
• PSA: 206.78000
• Density: 1.37g/cm³
• LogP: 1.54260
• Storage Temp.: Store at RT
• Solubility.: Aqueous Acid (Slightly), Water (Slightly, Heated)
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 270.11102425
• Heavy Atom Count: 17
• Complexity: 226

Purity/Quality:

Arcaine sulfate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(CCN=C(N)N)CN=C(N)N.OS(=O)(=O)O
• Uses: Arcaine sulfate is a novel and potent antagonist of the polyamine site on the NMDA receptor.

Technology Process of Arcaine sulfate

There total 2 articles about Arcaine sulfate 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: 62.0%

2-methylisothiourea sulphate (14527-26-5,867-44-7,147895-43-0) + 1,4-diaminobutane (110-60-1) → arcaine sulfate (14923-17-2,36587-93-6)

Guidance literature:

In water; for 5h; Heating;

DOI:10.1016/0968-0896(96)00108-3

Reference yield: 49.0%

S-Methylisothiourea sulfate (867-44-7,147895-43-0) + 1,4-diaminobutane (110-60-1) → arcaine sulfate (14923-17-2,36587-93-6)

Guidance literature:

In ethanol; water; for 18h; Reflux;

DOI:10.1021/jm8011933

upstream raw materials:

2-methylisothiourea sulphate

1,4-diaminobutane

S-Methylisothiourea sulfate