(3R,4R,5R,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol hydrochloride

• ChemBase ID: 105832
• Molecular Formular: C6H14ClNO5
• Molecular Mass: 215.63206
• Monoisotopic Mass: 215.05605023
• SMILES: Cl.O[C@H]1[C@@H](O)[C@H](OC(O)[C@@H]1N)CO
• Canonical SMILES: OC[C@H]1OC(O)[C@@H]([C@H]([C@H]1O)O)N.Cl
• InChI: InChI=1S/C6H13NO5.ClH/c7-3-5(10)4(9)2(1-8)12-6(3)11;/h2-6,8-11H,1,7H2;1H/t2-,3-,4+,5-,6?;/m1./s1
• InChIKey: QKPLRMLTKYXDST-BMZZJELJSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3R,4R,5R,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol hydrochloride
• IUPAC Traditional name: galactosamine hydrochloride
• Synonyms: Chondrosamine hydrochloride; 2-Amino-2-deoxy-D-galactopyranose hydrochloride; D-(+)-GALACTOSAMINE HYDROCHLORIDE

Database IDs

• CAS Number: 1772-03-8
• EC Number: 217-198-1
• PubChem SID: 162087179
• PubChem CID: 2723866

CALCULATED PROPERTIES

• Acid pKa: 11.726975
• H Acceptors: 6
• H Donor: 5
• LogD (pH = 5.5): -5.5965767
• LogD (pH = 7.4): -3.9292529
• Log P: -3.039421
• Molar Refractivity: 37.5809 cm^3
• Polarizability: 15.959335 Å^3
• Polar Surface Area: 116.17 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 182-185°C (dec.)

Safety Information

• Storage Condition: 2-8°C
• RTECS: LW5500000

Product Information

• Purity: 99%

DETAILS

MP Biomedicals - 02194669

Cell Culture Reagent
Hydrochloride
Purity: 99%