There will be a HazMat fee per item when shipping a dangerous goods. The HazMat fee will be charged to your UPS/DHL/FedEx collect account or added to the invoice unless the package is shipped via Ground service. Ship by air in Excepted Quantity (each bottle), which is up to 1g/1mL for class 6.1 packing group I or II, and up to 25g/25ml for all other HazMat items.
Type | HazMat fee for 500 gram (Estimated) |
Excepted Quantity | USD 0.00 |
Limited Quantity | USD 15-60 |
Inaccessible (Haz class 6.1), Domestic | USD 80+ |
Inaccessible (Haz class 6.1), International | USD 150+ |
Accessible (Haz class 3, 4, 5 or 8), Domestic | USD 100+ |
Accessible (Haz class 3, 4, 5 or 8), International | USD 200+ |
Purity | Size | Price | VIP Price | USA Stock *0-1 Day | Global Stock *5-7 Days | Quantity | |||||
{[ item.p_purity ]} | {[ item.pr_size ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} | Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]} | {[ item.pr_usastock ]} | Inquiry - | {[ item.pr_chinastock ]} | Inquiry - |
* Storage: {[proInfo.prStorage]}
CAS No. : | 1502-46-1 | MDL No. : | N/A |
Formula : | C6H3N7O3 | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | PBKYCCOBOHDCIT-UHFFFAOYSA-N |
M.W : | 221.13 | Pubchem ID : | 291317 |
Synonyms : |
|
Num. heavy atoms : | 16 |
Num. arom. heavy atoms : | 13 |
Fraction Csp3 : | 0.0 |
Num. rotatable bonds : | 0 |
Num. H-bond acceptors : | 6.0 |
Num. H-bond donors : | 3.0 |
Molar Refractivity : | 50.15 |
TPSA : | 141.66 Ų |
GI absorption : | Low |
BBB permeant : | No |
P-gp substrate : | No |
CYP1A2 inhibitor : | No |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -8.68 cm/s |
Log Po/w (iLOGP) : | -0.59 |
Log Po/w (XLOGP3) : | -1.45 |
Log Po/w (WLOGP) : | -2.66 |
Log Po/w (MLOGP) : | -1.71 |
Log Po/w (SILICOS-IT) : | -0.02 |
Consensus Log Po/w : | -1.29 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 1.0 |
Egan : | 1.0 |
Muegge : | 0.0 |
Bioavailability Score : | 0.55 |
Log S (ESOL) : | -0.9 |
Solubility : | 27.9 mg/ml ; 0.126 mol/l |
Class : | Very soluble |
Log S (Ali) : | -1.02 |
Solubility : | 21.1 mg/ml ; 0.0952 mol/l |
Class : | Very soluble |
Log S (SILICOS-IT) : | -1.63 |
Solubility : | 5.2 mg/ml ; 0.0235 mol/l |
Class : | Soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 1.0 |
Synthetic accessibility : | 1.59 |
Signal Word: | Danger | Class: | 8 |
Precautionary Statements: | P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P310-P332+P313-P362-P403+P233-P405-P501 | UN#: | 3263 |
Hazard Statements: | H315-H318-H335 | Packing Group: | Ⅲ |
GHS Pictogram: |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
With diethyl ether |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
Man erhitzt, solange noch Gase entweichen, und loest den Rueckstand in heisser konz. Kalilauge; |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
With nitric acid |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
With phosphorus pentachloride at 218℃; | ||
With phosphorus pentachloride; trichlorophosphate for 6h; Heating / reflux; | 3.2 3.2. Chlorination of cyameluric acid with POCl3 as a reaction media; In a 1-litre two-necked flask equipped with reflux condenser and side stop-cock were placed 500 ml of POCl3. Under flowing inert gas and stirring a powdered mixture of 100.0 g (0.472 mmol) of PCl5 and 31.0 g (0.14 mmol) of dried cyameluric acid were added using a powder funnel. The mixture was then refluxed for 6 h, whereby a vigorous reaction was observed and a yellow colour developed gradually. The POCl3 and the excessive PCl5 were removed by distillation using a simple glass tube connection (temperature of the oil bath was approximately 160 °C). The yellow residue in the flask was transferred into a glove-box with gas regeneration (≤0.5 ppm oxygen; ≤0.2 ppm water). After sublimation (see below) less than 2 g of cyameluric chloride was obtained as described below. | |
With phosphorus pentachloride; trichlorophosphate |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
dann spaltet sich das Ammelid in Ammoniak und Melanurensaeure und zuletzt in Cyanursaeure; |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
beim Erhitzen; |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
97% | at 160℃; for 10h; |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
With water Acidic conditions; | 2.1 2.1. Preparation of cyameluric acid, H3[C6N7O3]; The synthesis of the cyameluric acid was performed in accordance with standard procedures known in the state of the art as it is by acidifying a solution of its alkaline salt, previously obtained as indicated above. The acid, that has a very slow solubility in water, precipitates from the solution and can be separated by filtration. |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
by fluorination; |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
Stage #1: cyamelluric acid With water; potassium hydroxide for 1h; Heating; Stage #2: at 0℃; | Synthesis of potassium cyamelurate (K3C6N7O3·3H2O) Potassium cyamelurate is obtained via hydrolysis of melon (5g) in an aqueous KOH solution (50 mL, 2.5 molar) by boiling the mixture for 1 hour [34]. The reaction mixture was exposed to hot filtration. In order to increase the yield, the filtered solution was cooled to 0°C. Precipitated colorless needle crystals were immediately filtered off from the mother liquor on aglass filter and washed several times successively with ethanol and acetone. The crystals were air-dried at room temperature. |