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[ CAS No. 122030-04-0 ] {[proInfo.proName]}

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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+
3d Animation Molecule Structure of 122030-04-0
Chemical Structure| 122030-04-0
Chemical Structure| 122030-04-0
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Product Details of [ 122030-04-0 ]

CAS No. :122030-04-0 MDL No. :MFCD00190109
Formula : C7H2F6 Boiling Point : -
Linear Structure Formula :- InChI Key :SGPXFVDJRSZIPK-UHFFFAOYSA-N
M.W : 200.08 Pubchem ID :2734030
Synonyms :

Calculated chemistry of [ 122030-04-0 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 13
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.14
Num. rotatable bonds : 1
Num. H-bond acceptors : 6.0
Num. H-bond donors : 0.0
Molar Refractivity : 31.32
TPSA : 0.0 Ų

Pharmacokinetics

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) : -5.31 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.97
Log Po/w (XLOGP3) : 3.11
Log Po/w (WLOGP) : 5.54
Log Po/w (MLOGP) : 4.63
Log Po/w (SILICOS-IT) : 4.14
Consensus Log Po/w : 3.88

Druglikeness

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

Water Solubility

Log S (ESOL) : -3.32
Solubility : 0.0968 mg/ml ; 0.000484 mol/l
Class : Soluble
Log S (Ali) : -2.78
Solubility : 0.333 mg/ml ; 0.00167 mol/l
Class : Soluble
Log S (SILICOS-IT) : -4.13
Solubility : 0.015 mg/ml ; 0.0000748 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.4

Safety of [ 122030-04-0 ]

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