Sulfuric acid;8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;tetrahydrate

Base Information

• Chemical Name: Sulfuric acid;8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;tetrahydrate
• CAS No.: 64058-48-6
• Molecular Formula: C14H34N2O15S
• Molecular Weight: 502.4892
• European Community (EC) Number: 613-422-0
• NCI Thesaurus Code: C90692
• Mol file: 64058-48-6.mol

Synonyms:Spectinomycin sulfate tetrahydrate;64058-48-6;Sulfuric acid;8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;tetrahydrate;CHEBI:201769;suluric acid;(1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one

Chemical Property of Sulfuric acid;8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;tetrahydrate

Chemical Property:

• Appearance/Colour: White crystalline
• Vapor Pressure: 5.05E-16mmHg at 25°C
• Melting Point: ~185° (dec)
• Boiling Point: 583.1 °C at 760 mmHg
• PKA: pKa1 7.00, pKa2 8.75(at 25℃)
• Flash Point: 306.4 °C
• PSA: 229.18000
• LogP: -1.29300
• Storage Temp.: -20°C Freezer, Under inert atmosphere
• Solubility.: DMSO (Slightly), Water (Slightly)
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 2
• Exact Mass: 502.16798956
• Heavy Atom Count: 32
• Complexity: 559

Purity/Quality:

99% ^*data from raw suppliers

Spectinomycin sulfate tetrahydrate ^*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: CC1CC(=O)C2(C(O1)OC3C(C(C(C(C3O2)NC)O)NC)O)O.O.O.O.O.OS(=O)(=O)O
• Uses: Spectinomycin Sulfate Tetrahydrate (cas# 64058-48-6) is a compound useful in organic synthesis.