成人免费xx,国产又黄又湿又刺激不卡网站,成人性视频app菠萝网站,色天天天天

Home Cart 0 Sign in  

[ CAS No. 69605-90-9 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 69605-90-9
Chemical Structure| 69605-90-9
Structure of 69605-90-9 * 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 [ 69605-90-9 ]

Related Doc. of [ 69605-90-9 ]

Alternatived Products of [ 69605-90-9 ]
Product Citations

Product Details of [ 69605-90-9 ]

CAS No. :69605-90-9 MDL No. :MFCD08703631
Formula : C13H12O Boiling Point : -
Linear Structure Formula :C6H5C6H4CH2OH InChI Key :WGUZZTGZDPJWSG-UHFFFAOYSA-N
M.W : 184.23 Pubchem ID :603556
Synonyms :

Calculated chemistry of [ 69605-90-9 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 14
Num. arom. heavy atoms : 12
Fraction Csp3 : 0.08
Num. rotatable bonds : 2
Num. H-bond acceptors : 1.0
Num. H-bond donors : 1.0
Molar Refractivity : 58.01
TPSA : 20.23 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : Yes
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -5.07 cm/s

Lipophilicity

Log Po/w (iLOGP) : 2.34
Log Po/w (XLOGP3) : 3.32
Log Po/w (WLOGP) : 2.69
Log Po/w (MLOGP) : 3.08
Log Po/w (SILICOS-IT) : 3.42
Consensus Log Po/w : 2.97

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -3.58
Solubility : 0.0489 mg/ml ; 0.000265 mol/l
Class : Soluble
Log S (Ali) : -3.42
Solubility : 0.0699 mg/ml ; 0.000379 mol/l
Class : Soluble
Log S (SILICOS-IT) : -4.74
Solubility : 0.00332 mg/ml ; 0.000018 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.57

Safety of [ 69605-90-9 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 69605-90-9 ]

* 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 [ 69605-90-9 ]

[ 69605-90-9 ] Synthesis Path-Downstream   1~10

  • 1
  • [ 716-76-7 ]
  • [ 69605-90-9 ]
YieldReaction ConditionsOperation in experiment
95% Biphenyl-3-carboxylic acid (217.0 mg, 1.09 mmol) in THF was added to LiAlH4 (1.0 M in THF) (1.64 ml) at 00C under N2 during 15 min. The mixture was then stirred at r.t. for 2.5 h. H2O was carefully added to the mixture at 00C. NaOH (1.0 M) was added. The product was extracted wit EtOAc. The combined organic extracts were dried (MgSO4), filtered and concentrated yielding the title compound as a yellow oil (95%).1H NMR (CD3OD) delta 7.61-7.59 (m, 3H), 7.52-7.49 (m, IH), 7.45-7.38 (m, 3H), 7.35-7.30 (m, 2H), 4.67 (s, 2H).
95% With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20℃; for 2.75h;Inert atmosphere; Biphenyl-3-ylmethanol Biphenyl-3-carboxylic acid (217.0 mg, 1.09 mmol) in THF was added to LiAlH4 (1.0 M in THF) (1.64 ml) at 0 C. under N2 during 15 min. The mixture was then stirred at r.t. for 2.5 h. H2O was carefully added to the mixture at 0 C. NaOH (1.0 M) was added. The product was extracted with EtOAc. The combined organic extracts were dried (MgSO4), filtered and concentrated yielding the title compound as a yellow oil (95%). 1H NMR (CD3OD) delta 7.61-7.59 (m, 3H), 7.52-7.49 (m, 1H), 7.45-7.38 (m, 3H), 7.35-7.30 (m, 2H), 4.67 (s, 2H).
EXAMPLE III STR20 To a suspension of 100 mg of lithium aluminum hydride in 20 mL of ether was added 500 mg 3-phenylbenzoic acid. The reaction mixture was stirred at room temperature overnight. After any excess lithium aluminum hydride was destroyed with water, the organic layer was washed successively with 25 mL aliquots of dilute hydrochloric acid, dilute sodium hydroxide and brine. The organic phase was dried over anhydrous sodium sulfate and the solvent removed by evaporation under reduced pressure to yield 360 mg of 3-hydroxymethylbiphenyl as a crystalline solid.
  • 2
  • [ 2567-29-5 ]
  • [ 69605-90-9 ]
  • 3
  • [ 2928-43-0 ]
  • [ 69605-90-9 ]
  • 4
  • [ 69605-90-9 ]
  • [ 1204-60-0 ]
YieldReaction ConditionsOperation in experiment
With iodosylbenzene; In acetonitrile; at 60℃; for 2h; General procedure: Oxidation of alcohols was typically carried out as follows: a suspension with 5 mg of the synthesized catalyst in acetonitrile (2 mL) was magnetically stirred, and the substrate namely alcohols (0.1 mmol) and PhIO (2.5 equiv.) was then added. The resulting mixture was kept at 60 C with magnetical stirring for a set time. The selectivity and conversion were determined by GC analysis.
  • 5
  • [ 1016160-90-9 ]
  • [ 69605-90-9 ]
  • 6
  • [ 103668-94-6 ]
  • [ 69605-90-9 ]
  • 7
  • [ 82804-36-2 ]
  • [ 69605-90-9 ]
  • 8
  • [ 208941-39-3 ]
  • [ 98-80-6 ]
  • [ 69605-90-9 ]
  • 9
  • [ 69605-90-9 ]
  • [ 38580-82-4 ]
YieldReaction ConditionsOperation in experiment
In thionyl chloride; A solution of 50 mg of <strong>[69605-90-9]3-hydroxymethylbiphenyl</strong> in 1.5 mL thionyl chloride was heated at reflux temperature for 4 hr, cooled to room temperature and the solvent removed by evaporation under reduced pressure to yield 45 mg of 3-chloromethylbiphenyl which was used in the next step without further purification or characterization.
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 69605-90-9 ]

Aryls

Chemical Structure| 66888-79-7

[ 66888-79-7 ]

[1,1'-Biphenyl]-3,3'-diyldimethanol

Similarity: 1.00

Chemical Structure| 3597-91-9

[ 3597-91-9 ]

[1,1'-Biphenyl]-4-ylmethanol

Similarity: 1.00

Chemical Structure| 1667-12-5

[ 1667-12-5 ]

4,4'-Bis(hydroxymethyl)biphenyl

Similarity: 1.00

Chemical Structure| 35106-82-2

[ 35106-82-2 ]

(2-Vinylphenyl)methanol

Similarity: 0.96

Chemical Structure| 53076-11-2

[ 53076-11-2 ]

Bicyclo[4.2.0]octa-1,3,5-trien-3-ylmethanol

Similarity: 0.92

Alcohols

Chemical Structure| 66888-79-7

[ 66888-79-7 ]

[1,1'-Biphenyl]-3,3'-diyldimethanol

Similarity: 1.00

Chemical Structure| 3597-91-9

[ 3597-91-9 ]

[1,1'-Biphenyl]-4-ylmethanol

Similarity: 1.00

Chemical Structure| 1667-12-5

[ 1667-12-5 ]

4,4'-Bis(hydroxymethyl)biphenyl

Similarity: 1.00

Chemical Structure| 35106-82-2

[ 35106-82-2 ]

(2-Vinylphenyl)methanol

Similarity: 0.96

Chemical Structure| 53076-11-2

[ 53076-11-2 ]

Bicyclo[4.2.0]octa-1,3,5-trien-3-ylmethanol

Similarity: 0.92

; ;