ChemicalBook > CAS DataBase List > 3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole

3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole

Product Name
3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
CAS No.
1309788-50-8
Chemical Name
3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Synonyms
3-iodo-6,6-dimethyl-1,4,5,7-tetrahydroindazole;3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole;1H-Indazole, 4,5,6,7-tetrahydro-3-iodo-6,6-dimethyl-
CBNumber
CB13374659
Molecular Formula
C9H13IN2
Formula Weight
276.12
MOL File
1309788-50-8.mol
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3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole Property

Boiling point:
360.1±42.0 °C(Predicted)
Density 
1.640±0.06 g/cm3(Predicted)
storage temp. 
under inert gas (nitrogen or Argon) at 2–8 °C
pka
12.56±0.40(Predicted)
Appearance
Off-white to yellow Solid
InChI
InChI=1S/C9H13IN2/c1-9(2)4-3-6-7(5-9)11-12-8(6)10/h3-5H2,1-2H3,(H,11,12)
InChIKey
ZDWZKCXTTCFVQE-UHFFFAOYSA-N
SMILES
N1C2=C(CCC(C)(C)C2)C(I)=N1
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

AK Scientific
Product number
1117DP
Product name
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Packaging
100mg
Price
$118
Updated
2021/12/16
Chemenu
Product number
CM231817
Product name
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Purity
95+%
Packaging
250mg
Price
$154
Updated
2021/12/16
Ambeed
Product number
A312056
Product name
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Purity
97%
Packaging
1g
Price
$176
Updated
2021/12/16
Acrotein
Product number
UT00365
Product name
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Purity
97%
Packaging
0.25g
Price
$258.33
Updated
2021/12/16
Crysdot
Product number
CD11297095
Product name
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
Purity
97%
Packaging
250mg
Price
$284
Updated
2021/12/16
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3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole Chemical Properties,Usage,Production

Synthesis

1309788-49-5

1309788-50-8

Step 3: 6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole (0.50 g, 3.33 mmol) was dissolved in DMF (8 mL) at room temperature and powdered potassium hydroxide (560 mg, 10.0 mmol) and iodine (1.69 g, 6.66 mmol) were added sequentially. The reaction mixture was stirred for 45 min until the color changed to maroon. Upon completion of the reaction, the reaction was quenched with 10% Na2S2O3 aqueous solution, diluted with water and extracted with EtOAc (2×). The organic phases were combined, washed with water (3×), dried over MgSO4 and concentrated to give 3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole (920 mg, 99% yield) as a pale yellow waxy solid.1H NMR (CDCl3, 300 MHz) δ (ppm): 2.44 (s, 2H), 2.35 (t, J = 6.4 Hz, 2H), 1.55 (t, J = 6.4 Hz, 2H), 1.01 (s, 6H).

References

[1] Patent: WO2013/30138, 2013, A1. Location in patent: Page/Page column 196
[2] Patent: US2011/306599, 2011, A1. Location in patent: Page/Page column 32; 33
[3] Patent: WO2014/41518, 2014, A1. Location in patent: Page/Page column 37

3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole Preparation Products And Raw materials

Raw materials

Preparation Products

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3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole Suppliers

Beijing Yisiyan Technology Research Center
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010-56645598 13366904824
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01062230033
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bjkaida@163.com
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China
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Shanghai Synthfine Chemical Co.,Ltd
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sales@synthfine.com
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China
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1045
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skychemical Co.Ltd
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China
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Amadis Chemical Company Limited
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571-89925085
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0086-571-89925065
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sales@amadischem.com
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China
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Biokitchen
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021-021-021-31663258 13795219287
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021-31663258
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Aikon International Limited
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Labnetwork lnc.
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NINGBOBENKANGJS PHARMTECHCO., LTD
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+8615990591583 15990591583
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CHINA
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Ningbo Benkang jishi Pharmaceutical Technology Co., Ltd.
Tel
15990591583
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qq: 1050376806 mailbox : sales@nbpharmabridge.com
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China
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Shanghai Sunmonth Technology Co., LTD
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15216675652
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xuanyuelj@163.com
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View Lastest Price from 3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole manufacturers

ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD
Product
3-Iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole 1309788-50-8
Price
US $2.00-6.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
100kg
Release date
2025-08-06

1309788-50-8, 3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazoleRelated Search:


  • 3-iodo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole
  • 1H-Indazole, 4,5,6,7-tetrahydro-3-iodo-6,6-dimethyl-
  • 3-iodo-6,6-dimethyl-1,4,5,7-tetrahydroindazole
  • 1309788-50-8