(2S)-2,6-diaminohexanoic acid hydrochloride

• ChemBase ID: 102574
• Molecular Formular: C6H15ClN2O2
• Molecular Mass: 182.6485
• Monoisotopic Mass: 182.08220541
• SMILES: Cl.NCCCC[C@H](N)C(=O)O
• Canonical SMILES: NCCCC[C@@H](C(=O)O)N.Cl
• InChI: InChI=1S/C6H14N2O2.ClH/c7-4-2-1-3-5(8)6(9)10;/h5H,1-4,7-8H2,(H,9,10);1H/t5-;/m0./s1
• InChIKey: BVHLGVCQOALMSV-JEDNCBNOSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2S)-2,6-diaminohexanoic acid hydrochloride
• IUPAC Traditional name: L-lysine hydrochloride
• Synonyms: (S)-2,6-Diaminohexanoic acid monohydrochloride; L-Lysine hydrochloride solution; 2,6-Diaminohexanoic acid monohydrochloride; L-LYSINE MONO HYDROCHLORIDE; H-Lys-OH.HCl; 2,6-dianiohexanoic acid hydrochloride; L-LYSINE HYDROCHLORIDE; L-LYCINE MONO HCl; LYSINE MONOHYDROCHLORIDE, USP; L-Lysine monohydrochloride; L-赖氨酸盐酸盐 溶液; L-赖氨酸单盐酸盐; (S)-2,6-二氨基己酸 单盐酸盐; L-赖氨酸 单盐酸盐

Database IDs

• CAS Number: 10098-89-2; 657-27-2
• EC Number: 231-791-2; 211-519-9
• MDL Number: MFCD00064564
• Beilstein Number: 5460909; 3563889
• Merck Index: 145636
• PubChem SID: 24896408; 162090294; 24896451; 24867724
• PubChem CID: 69568

CALCULATED PROPERTIES

• Acid pKa: 2.7382863
• H Acceptors: 4
• H Donor: 3
• LogD (pH = 5.5): -5.9555907
• LogD (pH = 7.4): -4.978252
• Log P: -3.2145348
• Molar Refractivity: 37.8095 cm^3
• Polarizability: 15.365045 Å^3
• Polar Surface Area: 89.34 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: H2O: soluble100 mg/mL
• Melting Point: 263 °C (dec.)(lit.); 263°C; ca 260°C dec.
• Optical Rotation: [α]20/D +20.5±0.5°, c = 5% in 5 M HCl; [α]20/D +21°, c = 8 in 5 M HCl; +20 (c=5 in 5N HCl)

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: OL5650000
• UN Number: 1789
• German water hazard class: 1; 2
• Hazard Class: 8
• Packing Group: 3
• TSCA Listed: 是
• Personal Protective Equipment: Eyeshields, Gloves; Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• RID/ADR: UN 1789 8/PG 3
• Storage Temperature: 20-25°C; 2-8°C

Product Information

• Purity: ≥99%; ≥98% (TLC); ≥98.5%; ≥99%; ≥99.0%; ≥99.0% (AT); 98%; 98.5-101.5%; 99+%
• Concentration: 100 mM amino acid in 0.1 M HCl
• Grade: analytical standard; certified reference material; EP; JP; PharmaGrade; reagent grade; SAJ special grade; TraceCERT®; USP
• Suitability: suitable for cell culture; suitable for manufacturing use
• Ignition Residue: ≤0.1% (as SO4)
• Impurities: endotoxin, tested
• Cation Traces: Ca: ≤100 mg/kg; Cd: ≤5 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤5 mg/kg; Fe: ≤10 mg/kg; K: ≤500 mg/kg; Mg: ≤100 mg/kg; Mn: ≤5 mg/kg; Na: ≤500 mg/kg; NH4+: ≤200 mg/kg; Ni: ≤5 mg/kg; Pb: ≤5 mg/kg; Zn: ≤5 mg/kg
• Antion Traces: sulfate (SO42-): ≤200 mg/kg
• Biological Source: from non-animal source
• Loss on Drying: ≤0.5% loss on drying, 20 °C (HV)
• Quality Level: GMP-COMPENDIA
• Linear Formula: H2N(CH2)4CH(NH2)CO2H·HCl
• Empirical Formula (Hill Notation): C6H14N2O2 · HCl

DETAILS

MP Biomedicals - 02194697

Cell Culture Reagent
Hydrochloride
Crystalline
Purity: 99+%

MP Biomedicals - 02199609

Assay: 98.5-101.5%
Specific rotation: +20.4 to +21.4
Loss on drying: <0.4%
Residue on ignition: <0.1%
Chloride: 19.0-19.6%
Sulfate: <0.03%
Arsenic: <1.5%
Iron: <0.003%
Heavy metals: <0.0015%
Organic volatile impurities: passes.

MP Biomedicals - 05207779

MP Biomedicals Rare Chemical collection

MP Biomedicals - 02102218

Monohydrochloride
Crystalline
Purity: 99+%

Sigma Aldrich - L7039

Packaging
Manufactured and Packaged under CGMP

Sigma Aldrich - 67448

Analysis Note
This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO Guide 34. This CRM is traceable to NIST SRM.
General description
Certified content by quantitative NMR incl. uncertainty and expiry are given in the certificate.Download your certificate at: http://www.sigma-aldrich.com.
Legal Information
TraceCERT is a registered trademark of Sigma-Aldrich Co. LLC

Sigma Aldrich - L5626

包装
1 kg in poly bottle
100, 500 g in poly bottle
5 kg in poly drum