D-Pantothenic acid calcium salt hydrate

Base Information

• Chemical Name: D-Pantothenic acid calcium salt hydrate
• CAS No.: 63409-48-3
• Molecular Formula: C18H32CaN2O10
• Molecular Weight: 494.5474
• Hs Code.: 28353990
• European Community (EC) Number: 613-213-4
• Mol file: 63409-48-3.mol

Synonyms:D-Pantothenic acid calcium salt hydrate;331748-07-3;63409-48-3;Calcium 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate hydrate;Calcium3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoatehydrate;calcium;3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;hydrate;calcium bis{3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate} hydrate

Chemical Property of D-Pantothenic acid calcium salt hydrate

Chemical Property:

• Appearance/Colour: White powder, slightly hygroscopic
• Melting Point: 138 °C (dec.)(lit.)
• Boiling Point: 551.5 °C at 760 mmHg
• Flash Point: 287.3 °C
• PSA: 191.72000
• LogP: -1.45900
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 10
• Exact Mass: 494.1788508
• Heavy Atom Count: 32
• Complexity: 233

Purity/Quality:

99% ^*data from raw suppliers

CalciumDL-Pantothenate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.O.[Ca+2]
• Uses: vitamin B5 Calcium DL-Pantothenate can be used for the characterization of carbon-containing aerosolized drugs using laser-?induced breakdown spectroscopy.