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10098-89-2 molecular structure
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(2S)-2,6-diaminohexanoic acid hydrochloride

ChemBase ID: 102574
Molecular Formular: C6H15ClN2O2
Molecular Mass: 182.6485
Monoisotopic Mass: 182.08220541
SMILES and InChIs

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

Cite this record

CBID:102574 http://www.chembase.cn/molecule-102574.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

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

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 2.7382863  H Acceptors
H Donor LogD (pH = 5.5) -5.9555907 
LogD (pH = 7.4) -4.978252  Log P -3.2145348 
Molar Refractivity 37.8095 cm3 Polarizability 15.365045 Å3
Polar Surface Area 89.34 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
H2O: soluble100 mg/mL expand Show data source
Melting Point
263 °C (dec.)(lit.) expand Show data source
263°C expand Show data source
ca 260°C dec. expand Show data source
Optical Rotation
[α]20/D +20.5±0.5°, c = 5% in 5 M HCl expand Show data source
[α]20/D +21°, c = 8 in 5 M HCl expand Show data source
+20 (c=5 in 5N HCl) expand Show data source
Storage Condition
Room Temperature (15-30°C) expand Show data source
RTECS
OL5650000 expand Show data source
UN Number
1789 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
1 expand Show data source
2 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
3 expand Show data source
TSCA Listed
expand Show data source
Personal Protective Equipment
Eyeshields, Gloves expand Show data source
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
RID/ADR
UN 1789 8/PG 3 expand Show data source
Storage Temperature
20-25°C expand Show data source
2-8°C expand Show data source
Purity
≥99% expand Show data source
≥98% (TLC) expand Show data source
≥98.5% expand Show data source
≥99% expand Show data source
≥99.0% expand Show data source
≥99.0% (AT) expand Show data source
98% expand Show data source
98.5-101.5% expand Show data source
99+% expand Show data source
Concentration
100 mM amino acid in 0.1 M HCl expand Show data source
Grade
analytical standard expand Show data source
certified reference material expand Show data source
EP expand Show data source
JP expand Show data source
PharmaGrade expand Show data source
reagent grade expand Show data source
SAJ special grade expand Show data source
TraceCERT® expand Show data source
USP expand Show data source
Certificate of Analysis
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Suitability
suitable for cell culture expand Show data source
suitable for manufacturing use expand Show data source
Ignition Residue
≤0.1% (as SO4) expand Show data source
Impurities
endotoxin, tested expand Show data source
Cation Traces
Ca: ≤100 mg/kg expand Show data source
Cd: ≤5 mg/kg expand Show data source
Co: ≤5 mg/kg expand Show data source
Cr: ≤5 mg/kg expand Show data source
Cu: ≤5 mg/kg expand Show data source
Fe: ≤10 mg/kg expand Show data source
K: ≤500 mg/kg expand Show data source
Mg: ≤100 mg/kg expand Show data source
Mn: ≤5 mg/kg expand Show data source
Na: ≤500 mg/kg expand Show data source
NH4+: ≤200 mg/kg expand Show data source
Ni: ≤5 mg/kg expand Show data source
Pb: ≤5 mg/kg expand Show data source
Zn: ≤5 mg/kg expand Show data source
Antion Traces
sulfate (SO42-): ≤200 mg/kg expand Show data source
Biological Source
from non-animal source expand Show data source
Loss on Drying
≤0.5% loss on drying, 20 °C (HV) expand Show data source
Quality Level
GMP-COMPENDIA expand Show data source
Linear Formula
H2N(CH2)4CH(NH2)CO2H·HCl expand Show data source
Empirical Formula (Hill Notation)
C6H14N2O2 · HCl expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02194697 external link
Cell Culture Reagent
Hydrochloride
Crystalline
Purity: 99+%
MP Biomedicals - 02199609 external link
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 external link
MP Biomedicals Rare Chemical collection
MP Biomedicals - 02102218 external link
Monohydrochloride
Crystalline
Purity: 99+%
Sigma Aldrich - L7039 external link
Packaging
Manufactured and Packaged under CGMP
Sigma Aldrich - 67448 external link
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 external link
包装
1 kg in poly bottle
100, 500 g in poly bottle
5 kg in poly drum

REFERENCES

REFERENCES

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PATENTS

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