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. 3522-07-4 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 3522-07-4
Chemical Structure| 3522-07-4
Structure of 3522-07-4 * 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 [ 3522-07-4 ]

Related Doc. of [ 3522-07-4 ]

Alternatived Products of [ 3522-07-4 ]
Product Citations

Product Details of [ 3522-07-4 ]

CAS No. :3522-07-4 MDL No. :MFCD09261132
Formula : C8H8N2O Boiling Point : No data available
Linear Structure Formula :- InChI Key :CYEQSOYROKGJDA-UHFFFAOYSA-N
M.W : 148.16 Pubchem ID :12639202
Synonyms :

Calculated chemistry of [ 3522-07-4 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 11
Num. arom. heavy atoms : 9
Fraction Csp3 : 0.12
Num. rotatable bonds : 1
Num. H-bond acceptors : 2.0
Num. H-bond donors : 1.0
Molar Refractivity : 42.59
TPSA : 37.91 ?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) : -5.64 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.22
Log Po/w (XLOGP3) : 2.2
Log Po/w (WLOGP) : 1.57
Log Po/w (MLOGP) : 0.84
Log Po/w (SILICOS-IT) : 2.02
Consensus Log Po/w : 1.57

Druglikeness

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

Water Solubility

Log S (ESOL) : -2.68
Solubility : 0.307 mg/ml ; 0.00207 mol/l
Class : Soluble
Log S (Ali) : -2.63
Solubility : 0.347 mg/ml ; 0.00234 mol/l
Class : Soluble
Log S (SILICOS-IT) : -3.02
Solubility : 0.142 mg/ml ; 0.000959 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.43

Safety of [ 3522-07-4 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P280-P305+P351+P338 UN#:
Hazard Statements:H302-H315-H319-H332-H335 Packing Group:
GHS Pictogram:

Application In Synthesis of [ 3522-07-4 ]

* 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.

  • Upstream synthesis route of [ 3522-07-4 ]
  • Downstream synthetic route of [ 3522-07-4 ]

[ 3522-07-4 ] Synthesis Path-Upstream   1~7

  • 1
  • [ 3522-07-4 ]
  • [ 152626-75-0 ]
Reference： [1] Bioorganic and Medicinal Chemistry, 2004, vol. 12, # 9, p. 2115 - 2137
  • 2
  • [ 331-64-6 ]
  • [ 3522-07-4 ]
YieldReaction ConditionsOperation in experiment
59% for 4 h; Reflux Intermediate 42:[0174] A mixture of 2-fluoro-4-methoxybenzaldehyde (1 g, 6.5 mmol) and hydrazine (7 mL) was heated to reflux for 4 h. The mixture was extracted with CH2(3/4. The combined organic layers were washed with water, brine, concentrated in vacuo, and purified by column chromatography (elution with PE/EtOAc=5: l) to afford 6-methoxy-lH-indazole (intermediate 42) (568 mg, 59percent) as a yellow solid. HPLC: 99percent, RT 2.159 min. MS (ESI) m/z 149.1[M + H]+.
55.5% at 120℃; for 30 h; Sealed tube Step A: 2-fluoro-4-methoxybenzaldehyde (6.5 g, 42.2 mmol) and 85percent hydrazine hydrate (50 mL) were sealed at 120 ° C.The tube was stirred for 30 hours. Water (50 mL) was added and extracted with ethyl acetate (50 mL×3).The combined organic phases were washed with water (20 mL x 2). Then water (100 mL) was added to the organic phase.The pH was adjusted to 1-2 with 2M hydrochloric acid and the layers were separated and the product was taken from aqueous. The aqueous phase was adjusted to pH 8-9 with a 2M aqueous sodium sulphate solution, then extracted with ethyl acetate (50mL×3) and dried over anhydrous sodium sulfate. Evaporate the solvent under reduced pressure.The product was recrystallized from methyl tert-butyl ether / petroleum ether to give 6-methoxy-1H-carbazole (31) (3.47 g).The yield was 55.5percent.
Reference： [1] Journal of Organic Chemistry, 2006, vol. 71, # 21, p. 8166 - 8172
[2] Journal of Medicinal Chemistry, 2011, vol. 54, # 8, p. 3076 - 3080
[3] Journal of Organic Chemistry, 2009, vol. 74, # 16, p. 6331 - 6334
[4] Patent: WO2012/3418, 2012, A2, . Location in patent: Page/Page column 73
[5] Patent: CN108727267, 2018, A, . Location in patent: Paragraph 0106; 0107; 0108
[6] Organic Process Research and Development, 2011, vol. 15, # 3, p. 565 - 569
[7] Journal of Organic Chemistry, 2006, vol. 71, # 21, p. 8166 - 8172
[8] Patent: WO2014/152144, 2014, A1, . Location in patent: Paragraph 0223
  • 3
  • [ 23244-88-4 ]
  • [ 74-88-4 ]
  • [ 3522-07-4 ]
Reference： [1] Journal of Medicinal Chemistry, 2010, vol. 53, # 5, p. 2324 - 2328
[2] Bioorganic and Medicinal Chemistry, 2008, vol. 16, # 4, p. 1966 - 1982
  • 4
  • [ 343773-70-6 ]
  • [ 3522-07-4 ]
Reference： [1] Liebigs Annalen der Chemie, 1980, # 6, p. 908 - 927
[2] Bioorganic and Medicinal Chemistry, 2004, vol. 12, # 9, p. 2115 - 2137
  • 5
  • [ 50868-72-9 ]
  • [ 3522-07-4 ]
Reference： [1] Bioorganic and Medicinal Chemistry, 2004, vol. 12, # 9, p. 2115 - 2137
[2] Liebigs Annalen der Chemie, 1980, # 6, p. 908 - 927
  • 6
  • [ 459-60-9 ]
  • [ 3522-07-4 ]
Reference： [1] Tetrahedron Letters, 2004, vol. 45, # 8, p. 1769 - 1771
  • 7
  • [ 23244-88-4 ]
  • [ 77-78-1 ]
  • [ 3522-07-4 ]
Reference： [1] Bulletin of the Chemical Society of Japan, 1985, vol. 58, # 1, p. 309 - 315
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 3522-07-4 ]

Ethers

Chemical Structure| 133841-05-1

[ 133841-05-1 ]

7-Methoxy-1H-indazole

Similarity: 0.91

Chemical Structure| 94444-96-9

[ 94444-96-9 ]

5-Methoxy-1H-indazole

Similarity: 0.85

Chemical Structure| 885520-83-2

[ 885520-83-2 ]

4-Bromo-6-methoxy-1H-indazole

Similarity: 0.83

Chemical Structure| 885519-30-2

[ 885519-30-2 ]

3-Bromo-5-methoxy-1H-indazole

Similarity: 0.83

Chemical Structure| 1206800-17-0

[ 1206800-17-0 ]

6-Bromo-5-methoxy-1H-indazole

Similarity: 0.83

Related Parent Nucleus of
[ 3522-07-4 ]

Indazoles

Chemical Structure| 15579-15-4

[ 15579-15-4 ]

1H-Indazol-5-ol

Similarity: 0.94

Chemical Structure| 133841-05-1

[ 133841-05-1 ]

7-Methoxy-1H-indazole

Similarity: 0.91

Chemical Structure| 201286-99-9

[ 201286-99-9 ]

6-Hydroxy-3-methylindazole

Similarity: 0.91

Chemical Structure| 94444-96-9

[ 94444-96-9 ]

5-Methoxy-1H-indazole

Similarity: 0.85

Chemical Structure| 885519-30-2

[ 885519-30-2 ]

3-Bromo-5-methoxy-1H-indazole

Similarity: 0.83

; ;