539813

3-Amino-5-bromobenzotrifluoride

97%

Manufacturer: Sigma Aldrich

CAS Number: 54962-75-3

Select a Size

Pack Size SKU Availability Price
5 G 539813-5-G In Stock ₹ 2,673.78

539813 - 5 G

₹ 2,673.78

In Stock

Quantity

1

Base Price: ₹ 2,673.78

GST (18%): ₹ 481.28

Total Price: ₹ 3,155.06

Quality Level

100

Assay

97%

refractive index

n20/D 1.528 (lit.)

bp

220-223 °C (lit.)

density

1.697 g/mL at 25 °C (lit.)

SMILES string

Nc1cc(Br)cc(c1)C(F)(F)F

InChI

1S/C7H5BrF3N/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H,12H2

InChI key

HJTLKVYOWNTDPF-UHFFFAOYSA-N

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Description

  • Application: 3-Amino-5-bromobenzotrifluoride may be used in the synthesis of 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline.[1]

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Precautionary Statements

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Quality Level:
100

Assay:
97%

refractive index:
n20/D 1.528 (lit.)

bp:
220-223 °C (lit.)

density:
1.697 g/mL at 25 °C (lit.)

SMILES string:
Nc1cc(Br)cc(c1)C(F)(F)F

InChI:
1S/C7H5BrF3N/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H,12H2

InChI key:
HJTLKVYOWNTDPF-UHFFFAOYSA-N

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SMILES string:
Fc1ccc(cc1)C2CC(=O)CC(=O)C2

InChI:
1S/C12H11FO2/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-4,9H,5-7H2

InChI key:
LBTLJACXBCUFEF-UHFFFAOYSA-N

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Fc1c(F)c(F)c(OC(=O)Oc2c(F)c(F)c(F)c(F)c2F)c(F)c1F

InChI:
1S/C13F10O3/c14-1-3(16)7(20)11(8(21)4(1)17)25-13(24)26-12-9(22)5(18)2(15)6(19)10(12)23

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IOVVFSGCNWQFQT-UHFFFAOYSA-N

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InChI:
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InChI key:
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