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[ CAS No. 65799-47-5 ] {[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| 65799-47-5
Chemical Structure| 65799-47-5
Structure of 65799-47-5 * Storage: {[proInfo.prStorage]}
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Product Details of [ 65799-47-5 ]

CAS No. :65799-47-5 MDL No. :MFCD00271003
Formula : C9H20O4Si Boiling Point : -
Linear Structure Formula :- InChI Key :WHGNXNCOTZPEEK-UHFFFAOYSA-N
M.W : 220.34 Pubchem ID :2759249
Synonyms :

Calculated chemistry of [ 65799-47-5 ]

Physicochemical Properties

Num. heavy atoms : 14
Num. arom. heavy atoms : 0
Fraction Csp3 : 1.0
Num. rotatable bonds : 8
Num. H-bond acceptors : 4.0
Num. H-bond donors : 0.0
Molar Refractivity : 55.47
TPSA : 40.22 Ų

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.95 cm/s

Lipophilicity

Log Po/w (iLOGP) : 3.02
Log Po/w (XLOGP3) : 0.98
Log Po/w (WLOGP) : 1.16
Log Po/w (MLOGP) : -0.51
Log Po/w (SILICOS-IT) : 0.51
Consensus Log Po/w : 1.03

Druglikeness

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

Water Solubility

Log S (ESOL) : -1.3
Solubility : 11.2 mg/ml ; 0.0506 mol/l
Class : Very soluble
Log S (Ali) : -1.41
Solubility : 8.52 mg/ml ; 0.0387 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -2.06
Solubility : 1.94 mg/ml ; 0.00881 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 2.0 alert
Leadlikeness : 2.0
Synthetic accessibility : 4.33

Safety of [ 65799-47-5 ]

Signal Word:Danger Class:9
Precautionary Statements:P261-P273-P280-P305+P351+P338 UN#:3082
Hazard Statements:H315-H317-H318-H335-H411 Packing Group:
GHS Pictogram:
Same Skeleton Products
Historical Records

Related Functional Groups of
[ 65799-47-5 ]

Organosilicon

Chemical Structure| 2897-60-1

[ 2897-60-1 ]

Diethoxy(methyl)(3-(oxiran-2-ylmethoxy)propyl)silane

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