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[ CAS No. 10497-05-9 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
HazMat Fee +

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+
Chemical Structure| 10497-05-9
Chemical Structure| 10497-05-9
Structure of 10497-05-9 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 10497-05-9 ]

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Product Details of [ 10497-05-9 ]

CAS No. :10497-05-9 MDL No. :MFCD00008267
Formula : C9H27O4PSi3 Boiling Point : -
Linear Structure Formula :- InChI Key :QJMMCGKXBZVAEI-UHFFFAOYSA-N
M.W : 314.54 Pubchem ID :25317
Synonyms :

Calculated chemistry of [ 10497-05-9 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 17
Num. arom. heavy atoms : 0
Fraction Csp3 : 1.0
Num. rotatable bonds : 6
Num. H-bond acceptors : 4.0
Num. H-bond donors : 0.0
Molar Refractivity : 80.9
TPSA : 54.57 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : Yes
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -5.53 cm/s

Lipophilicity

Log Po/w (iLOGP) : 3.82
Log Po/w (XLOGP3) : 3.79
Log Po/w (WLOGP) : 4.65
Log Po/w (MLOGP) : 1.36
Log Po/w (SILICOS-IT) : -2.2
Consensus Log Po/w : 2.28

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 0.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -3.78
Solubility : 0.052 mg/ml ; 0.000165 mol/l
Class : Soluble
Log S (Ali) : -4.63
Solubility : 0.00737 mg/ml ; 0.0000234 mol/l
Class : Moderately soluble
Log S (SILICOS-IT) : -2.9
Solubility : 0.397 mg/ml ; 0.00126 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 2.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 4.82

Safety of [ 10497-05-9 ]

Signal Word:Danger Class:3
Precautionary Statements:P210-P261-P305+P351+P338 UN#:1993
Hazard Statements:H225-H315-H319-H335 Packing Group:
GHS Pictogram:
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