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About This Item
Empirical Formula (Hill Notation):
C6H9N3O2 · HCl · H2O
CAS Number:
Molecular Weight:
209.63
UNSPSC Code:
12352209
NACRES:
NA.21
EC Index Number:
211-438-9
MDL number:
Beilstein/REAXYS Number:
4168261
vapor pressure
<1 hPa ( 20 °C)
Quality Level
form
crystalline powder
pH
3.5-4.5 (20 °C, 100 g/L in H2O)
mp
254 °C (dec.) (lit.)
solubility
149.55 g/L
density
1.49 g/cm3 at 20 °C
bulk density
770 kg/m3
storage temp.
2-30°C
SMILES string
O.Cl.N[C@@H](Cc1c[nH]cn1)C(O)=O
InChI
1S/C6H9N3O2.ClH.H2O/c7-5(6(10)11)1-4-2-8-3-9-4;;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1H;1H2/t5-;;/m0../s1
InChI key
CMXXUDSWGMGYLZ-XRIGFGBMSA-N
Analysis Note
Assay (alkalimetric, calculated on dried substance): ≥ 99.0 %
Identity (IR-spectrum): passes test
Appearance: white to almost white crystalline powder or colorless crystals
Appearance of solution (50 g/l CO₂-free water): clear and colorless
Spec. rotation (α 20/D, 110 g/l, hydrochloric acid 120 g/l, calc. on dried substance): +9.2 to +10.6
Sulfate (SO₄): ≤ 0.02 %
Heavy metals (as Pb): ≤ 0.001 %
As (Arsenic): ≤ 0.0005 %
Ca (Calcium): ≤ 0.001 %
Co (Cobalt): ≤ 0.0005 %
Fe (Iron): ≤ 0.0005 %
K (Potassium): ≤ 0.0005 %
Mg (Magnesium): ≤ 0.0005 %
Na (Sodium): ≤ 0.005 %
NH₄ (Ammonium): ≤ 0.01 %
Zn (Zinc): ≤ 0.0005 %
Foreign amino acids: ≤ 0.3 %
Other ninhydrine positive substances: ≤ 0.1 %
Loss on drying (150 °C): 7.0 - 10.0 %
Identity (IR-spectrum): passes test
Appearance: white to almost white crystalline powder or colorless crystals
Appearance of solution (50 g/l CO₂-free water): clear and colorless
Spec. rotation (α 20/D, 110 g/l, hydrochloric acid 120 g/l, calc. on dried substance): +9.2 to +10.6
Sulfate (SO₄): ≤ 0.02 %
Heavy metals (as Pb): ≤ 0.001 %
As (Arsenic): ≤ 0.0005 %
Ca (Calcium): ≤ 0.001 %
Co (Cobalt): ≤ 0.0005 %
Fe (Iron): ≤ 0.0005 %
K (Potassium): ≤ 0.0005 %
Mg (Magnesium): ≤ 0.0005 %
Na (Sodium): ≤ 0.005 %
NH₄ (Ammonium): ≤ 0.01 %
Zn (Zinc): ≤ 0.0005 %
Foreign amino acids: ≤ 0.3 %
Other ninhydrine positive substances: ≤ 0.1 %
Loss on drying (150 °C): 7.0 - 10.0 %
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Storage Class
11 - Combustible Solids
flash_point_f
Not applicable
flash_point_c
Not applicable
Certificates of Analysis (COA)
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 1.04350.0500 | 04061839395558 |
| 1043500100 | 04022536050263 |
| 1043509010 | 04022536692692 |
| 1043500025 | 04022536050256 |
| 1043500500 | 04022536050270 |