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+ |
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CAS No. : | 152419-78-8 | MDL No. : | MFCD00800385 |
Formula : | C16H14S3 | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | WQUQHXQTTKKFGY-UHFFFAOYSA-N |
M.W : | 302.48 g/mol | Pubchem ID : | 5323635 |
Synonyms : |
|
Num. heavy atoms : | 19 |
Num. arom. heavy atoms : | 12 |
Fraction Csp3 : | 0.0 |
Num. rotatable bonds : | 6 |
Num. H-bond acceptors : | 0.0 |
Num. H-bond donors : | 0.0 |
Molar Refractivity : | 89.12 |
TPSA : | 75.9 Ų |
GI absorption : | High |
BBB permeant : | No |
P-gp substrate : | No |
CYP1A2 inhibitor : | Yes |
CYP2C19 inhibitor : | Yes |
CYP2C9 inhibitor : | Yes |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | Yes |
Log Kp (skin permeation) : | -3.89 cm/s |
Log Po/w (iLOGP) : | 3.86 |
Log Po/w (XLOGP3) : | 5.99 |
Log Po/w (WLOGP) : | 6.31 |
Log Po/w (MLOGP) : | 5.83 |
Log Po/w (SILICOS-IT) : | 5.47 |
Consensus Log Po/w : | 5.49 |
Lipinski : | 1.0 |
Ghose : | None |
Veber : | 0.0 |
Egan : | 1.0 |
Muegge : | 1.0 |
Bioavailability Score : | 0.55 |
Log S (ESOL) : | -5.56 |
Solubility : | 0.000832 mg/ml ; 0.00000275 mol/l |
Class : | Moderately soluble |
Log S (Ali) : | -7.36 |
Solubility : | 0.0000132 mg/ml ; 0.0000000436 mol/l |
Class : | Poorly soluble |
Log S (SILICOS-IT) : | -6.13 |
Solubility : | 0.000226 mg/ml ; 0.000000748 mol/l |
Class : | Poorly soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 1.0 |
Synthetic accessibility : | 2.65 |
Signal Word: | Danger | Class: | 9 |
Precautionary Statements: | P501-P273-P260-P270-P264-P280-P391-P314-P337+P313-P305+P351+P338-P301+P312+P330 | UN#: | 3077 |
Hazard Statements: | H302-H319-H372-H410 | Packing Group: | Ⅲ |
GHS Pictogram: |
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* 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.