天堂网亚洲,天天操天天搞,91视频高清,菠萝蜜视频在线观看入口,美女视频性感美女视频,95丝袜美女视频国产,超高清美女视频图片

Home Cart 0 Sign in  

[ CAS No. 85958-57-2 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
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| 85958-57-2
Chemical Structure| 85958-57-2
Structure of 85958-57-2 * Storage: {[proInfo.prStorage]}

Please Login or Create an Account to: See VIP prices and availability

Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Search after Editing

* Storage: {[proInfo.prStorage]}

* Shipping: {[proInfo.prShipping]}

Quality Control of [ 85958-57-2 ]

Related Doc. of [ 85958-57-2 ]

Alternatived Products of [ 85958-57-2 ]
Product Citations

Product Details of [ 85958-57-2 ]

CAS No. :85958-57-2 MDL No. :MFCD00052957
Formula : C6H3Cl2FO2S Boiling Point : -
Linear Structure Formula :- InChI Key :FCFPJKHVCHKCMP-UHFFFAOYSA-N
M.W : 229.06 Pubchem ID :522846
Synonyms :

Calculated chemistry of [ 85958-57-2 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 12
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.0
Num. rotatable bonds : 1
Num. H-bond acceptors : 3.0
Num. H-bond donors : 0.0
Molar Refractivity : 44.49
TPSA : 42.52 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -5.8 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.76
Log Po/w (XLOGP3) : 2.67
Log Po/w (WLOGP) : 3.91
Log Po/w (MLOGP) : 2.54
Log Po/w (SILICOS-IT) : 2.44
Consensus Log Po/w : 2.66

Druglikeness

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

Water Solubility

Log S (ESOL) : -3.25
Solubility : 0.13 mg/ml ; 0.000567 mol/l
Class : Soluble
Log S (Ali) : -3.21
Solubility : 0.14 mg/ml ; 0.00061 mol/l
Class : Soluble
Log S (SILICOS-IT) : -3.84
Solubility : 0.033 mg/ml ; 0.000144 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 2.07

Safety of [ 85958-57-2 ]

Signal Word:Danger Class:8
Precautionary Statements:P280-P305+P351+P338-P310 UN#:3265
Hazard Statements:H314 Packing Group:Ⅲ
GHS Pictogram:

Application In Synthesis of [ 85958-57-2 ]

* 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.

  • Downstream synthetic route of [ 85958-57-2 ]

[ 85958-57-2 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 878799-20-3 ]
  • [ 85958-57-2 ]
  • [ 878799-21-4 ]
YieldReaction ConditionsOperation in experiment
74% With triethylamine; In dichloromethane; at 20℃; for 2.0h; To a solution of 1 ,1 -dimethylethyl (3-aminobutyl)carbamate (0.10 g, 0.53 mmol) in CH2CI2 (5 ml_) were added 2-chloro-4-fluorobezenesulfonyl chloride (0.15 g, 0.64 mmol) and Et3N (0.22 ml_, 1.60 mmol) at rt. After 2 hr at rt, the reaction mixture was concentrated and purified by flash column chromatography on silica gel (Biotage, 5%-40% EtOAc/hexane) to provide 0.15g (74%) of the title compound.
Recommend Products
Same Skeleton Products

Technical Information

Historical Records
; ;