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2-Bromo-4-trifluoromethylaniline

2-Bromo-4-trifluoromethylaniline structure

CAS No:
57946-63-1
Formula:
C7H5BrF3N
Chemical Name:
2-Bromo-4-trifluoromethylaniline
Synonyms:
Benzenamine,2-bromo-4-(trifluoromethyl)-;2-Bromo-4-(trifluoromethyl)benzenamine;2-Bromo-4-trifluoromethylaniline;3-Bromo-4-aminobenzotrifluoride;2-Bromo-4-trifluoromethylphenylamine;4-Trifluoromethyl-2-bromoaniline;4-Amino-3-bromobenzotrifluoride
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

white crystals

2-Bromo-4-trifluoromethylaniline Basic Attributes

Molecular Weight：

240.02

Exact Mass：

240.02

BRN：

8139978

EC Number：

261-035-7

DSSTox ID：

DTXSID60206667

HScode：

2921420090

Characteristics

PSA：

XLogP3：

2.8

Appearance：

White Crystals

Density：

1.7±0.1 g/cm3

Melting Point：

26-28°C

Boiling Point：

109-110 °C10 mm Hg(lit.)

Flash Point：

110 °C

Refractive Index：

1.522

Safety Information

Hazard category：

6.1

Transport codes：

2810

wgk germany：

hazard class code：

36/37/38-20/21/22

safety instructions：

26-36-36/37/39

Marks：

Xi,Xn

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H302 (15.56%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-bromo-4-trifluoromethylaniline

2-Bromo-4-trifluoromethylaniline Use and Manufacturing

Add 200 mL of distilled CH2Cl 2 and 4- (trifluoromethyl) aniline (20 g, 124.13 mmol) to a two neck flask. Slowly dropwise N-bromosuccinimide (24.3 g, 136.5 mmol) dissolved in CH2Cl2. When the reaction is complete, extract with CH2Cl2. Purification by column separation (EA: Hx = 1: 4) (yield: 50percent)

Computed Properties

Molecular Weight:240.02
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:238.95575
Monoisotopic Mass:238.95575
Topological Polar Surface Area:26
Heavy Atom Count:12
Complexity:159
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 57946-63-1

Content: 99.00%

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Latest News on 2-Bromo-4-trifluoromethylaniline

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Guide of 2-Bromo-4-trifluoromethylaniline

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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2-Bromo-4-trifluoromethylaniline

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