ChemicalBook > CAS DataBase List > 1-METHYL-5-NITRO-1H-INDOLE

1-METHYL-5-NITRO-1H-INDOLE

Product Name
1-METHYL-5-NITRO-1H-INDOLE
CAS No.
29906-67-0
Chemical Name
1-METHYL-5-NITRO-1H-INDOLE
Synonyms
1-Methyl-5-Nitroindole;1-METHYL-5-NITRO-1H-INDOLE;1H-Indole, 1-Methyl-5-nitro-;1-Methyl-5-nitro-1H-indole ,97%
CBNumber
CB1207231
Molecular Formula
C9H8N2O2
Formula Weight
176.17
MOL File
29906-67-0.mol
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1-METHYL-5-NITRO-1H-INDOLE Property

Melting point:
167 °C
Boiling point:
339.2±15.0 °C(Predicted)
Density 
1.29±0.1 g/cm3(Predicted)
storage temp. 
2-8°C
solubility 
Chloroform (Slightly), DMSO (Slightly)
form 
Solid
color 
Dark Yellow to Very Dark Yellow
InChI
InChI=1S/C9H8N2O2/c1-10-5-4-7-6-8(11(12)13)2-3-9(7)10/h2-6H,1H3
InChIKey
PXBQSCHRKSBGKV-UHFFFAOYSA-N
SMILES
N1(C)C2=C(C=C([N+]([O-])=O)C=C2)C=C1
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Safety

Risk Statements 
22-41
Safety Statements 
26-39
HazardClass 
IRRITANT
HS Code 
29349990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P260Do not breathe dust/fume/gas/mist/vapours/spray.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

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N-Bromosuccinimide Price

TRC
Product number
M320970
Product name
1-Methyl-5-nitro-1H-indole
Packaging
5g
Price
$130
Updated
2021/12/16
AK Scientific
Product number
R932
Product name
1-Methyl-5-nitroindole
Packaging
10g
Price
$140
Updated
2021/12/16
Matrix Scientific
Product number
058680
Product name
1-Methyl-5-nitro-1H-indole
Purity
97%
Packaging
5g
Price
$187
Updated
2021/12/16
Apolloscientific
Product number
OR70135
Product name
1-Methyl-5-nitro-1H-indole
Packaging
1g
Price
$24
Updated
2021/12/16
SynQuest Laboratories
Product number
4H54-1-AF
Product name
1-Methyl-5-nitro-1H-indole
Packaging
1g
Price
$26
Updated
2021/12/16
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1-METHYL-5-NITRO-1H-INDOLE Chemical Properties,Usage,Production

Chemical Properties

Light yellow solid

Uses

1-Methyl-5-nitro-1H-indole is used as a reagent in the synthesis of the antiasthmatic drug Zafirlukast (Z125000).

Synthesis

6146-52-7

616-38-6

29906-67-0

91482-63-2

Example 14 Synthesis of 1-methyl-5-nitroindole. To a 500 mL three-necked flask equipped with a thermocouple, condenser tube, and constant pressure dropping funnel was added 5-nitroindole (20.0 g, 123 mmol), potassium carbonate (4.0 g, 29 mmol), N,N-dimethylformamide (80 mL), and dimethyl carbonate (22 mL, 261.4 mmol). The reaction mixture was heated to reflux. The reaction progress was monitored by high performance liquid chromatography (HPLC) or thin layer chromatography (TLC) (unfolding agent: heptane solution of 30% ethyl acetate). After 3 hours of refluxing, complete conversion of 5-nitroindole was confirmed by the analytical method described above. The reaction mixture was then cooled to 10±5°C and diluted with water (160 mL), at which point a yellow precipitate was generated. The mixture was continued to be stirred at room temperature for 2 h, after which the solid product was collected by filtration, washed with water (100 mL), and finally dried under high vacuum at 60-65 °C for 24 h. 1-methyl-5-nitroindole (21.1 g, 97.1% yield) was obtained as a yellow solid.

References

[1] Patent: US6326501, 2001, B1

1-METHYL-5-NITRO-1H-INDOLE Preparation Products And Raw materials

Raw materials

Preparation Products

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1-METHYL-5-NITRO-1H-INDOLE Suppliers

Shanghai Alan Pharmaceutical Co., LTD
Tel
021-58099609-8008 13816260319
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251218799@qq.com
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China
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J & K SCIENTIFIC LTD.
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18210857532; 18210857532
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86-10-82849933
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jkinfo@jkchemical.com
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China
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96815
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Energy Chemical
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021-021-58432009 400-005-6266
Fax
021-58436166
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sales8178@energy-chemical.com
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China
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Adamas Reagent, Ltd.
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400-6009262 16621234537
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021-64823266
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China
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Shanghai Longsheng chemical Co.,Ltd.
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021-58099652-8005 13585536065
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021-58099609
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bin.wu@shlschem.com
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China
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Nanjing Chemlin Chemical Co., Ltd
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+86-25-83453306
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China
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XiaoGan ShenYuan ChemPharm co,ltd
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15527768836
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1791901229@qq.com
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China
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Shanghai Ennopharm Co., Ltd.
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+86 (21) 6435-5022
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China
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Tongchuang Pharma(Suzhou). Co., Ltd.
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0512-63263366 18912765016
Fax
0512-6326 3366
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tongtf110@sina.com
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China
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991
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View Lastest Price from 1-METHYL-5-NITRO-1H-INDOLE manufacturers

Shaanxi Dideu New Materials Co. Ltd
Product
1-METHYL-5-NITRO-1H-INDOLE 29906-67-0
Price
US $0.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
10000KGS
Release date
2025-03-08
Career Henan Chemical Co
Product
1-METHYL-5-NITRO-1H-INDOLE 29906-67-0
Price
US $1.00/KG
Min. Order
1G
Purity
98%
Supply Ability
100KG
Release date
2018-08-06