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7-Bromo-5-nitro-1H-indole

7-Bromo-5-nitro-1H-indole structure

CAS No:
87240-07-1
Formula:
C8H5BrN2O2
Chemical Name:
7-Bromo-5-nitro-1H-indole
Synonyms:
1H-Indole,7-bromo-5-nitro-;7-Bromo-5-nitro-1H-indole
Categories:
Chemical Reagents > Organic Reagents

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7-Bromo-5-nitro-1H-indole Basic Attributes

Molecular Weight：

241.04

Exact Mass：

241.04

DSSTox ID：

DTXSID10397478

HScode：

2933990090

Characteristics

PSA：

61.6

XLogP3：

2.6

Density：

1.9±0.1 g/cm3

Boiling Point：

402.3°C at 760 mmHg

Flash Point：

197.1±23.2 °C

Refractive Index：

1.747

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

Marks：

Xi,T

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

7-Bromo-5-nitro-1H-indole Use and Manufacturing

7-Bromo-5-nitro-1H-indole (22B) DDQ (5.6 g, 24.69 mmol) and isopropanol (2 mL) were added to a solution of Example 22A (3 g, 12.34 mmol) in ethanol (30 mL), and the mixture was stirred at 80 °C for 48 h. The reaction mixture was concentrated under reduced pressure, and the residue was partitioned between ethyl acetate and water. Separated organic layer was washed with water, dried over sodium sulfate, filtered and the filtrate was concentrated in vacuo. The crude product was purified by flash chromatography using 20percent ethyl acetate in hexanes to afford the title compound (2.5 g, 84percent) as a yellow solid.

Computed Properties

Molecular Weight:241.04
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:239.95344
Monoisotopic Mass:239.95344
Topological Polar Surface Area:61.6
Heavy Atom Count:13
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Manufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acid

87240-07-1 7-bromo-5-nitro-1H-indole

CAS No.: 87240-07-1

Grade: Industrial Grade

Content: 95%

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Guide of 7-Bromo-5-nitro-1H-indole

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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7-Bromo-5-nitro-1H-indole

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