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[ CAS No. 16753-62-1 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
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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| 16753-62-1
Chemical Structure| 16753-62-1
Structure of 16753-62-1 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 16753-62-1 ]

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Product Details of [ 16753-62-1 ]

CAS No. :16753-62-1 MDL No. :MFCD00129170
Formula : C5H12O2Si Boiling Point : -
Linear Structure Formula :CH2CHSi(OCH3)2(CH3) InChI Key :ZLNAFSPCNATQPQ-UHFFFAOYSA-N
M.W : 132.23 Pubchem ID :85589
Synonyms :

Calculated chemistry of [ 16753-62-1 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 8
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.6
Num. rotatable bonds : 3
Num. H-bond acceptors : 2.0
Num. H-bond donors : 0.0
Molar Refractivity : 35.71
TPSA : 18.46 ?2

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) : -6.02 cm/s

Lipophilicity

Log Po/w (iLOGP) : 2.24
Log Po/w (XLOGP3) : 1.53
Log Po/w (WLOGP) : 1.08
Log Po/w (MLOGP) : 0.08
Log Po/w (SILICOS-IT) : -0.68
Consensus Log Po/w : 0.85

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -1.43
Solubility : 4.96 mg/ml ; 0.0375 mol/l
Class : Very soluble
Log S (Ali) : -1.53
Solubility : 3.93 mg/ml ; 0.0297 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -1.04
Solubility : 12.1 mg/ml ; 0.0916 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 3.79

Safety of [ 16753-62-1 ]

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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