Structure

5-Bromo-2,4-difluorophenylamine

CAS
452-92-6
Catalog Number
ACM452926
Category
Bromine Series
Molecular Weight
208.00
Molecular Formula
C7H7ClF2N2

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Specification

Hazard Statements
H315-H318-H335
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 5-Bromo-2,4-difluorophenylamine?

The molecular formula of 5-Bromo-2,4-difluorophenylamine is C6H4BrF2N.

What are some synonyms of 5-Bromo-2,4-difluorophenylamine?

Some synonyms of 5-Bromo-2,4-difluorophenylamine are 5-Bromo-2,4-difluoroaniline, 2,4-Difluoro-5-bromo-phenylamine, and Benzenamine, 5-bromo-2,4-difluoro-.

What is the molecular weight of 5-Bromo-2,4-difluorophenylamine?

The molecular weight of 5-Bromo-2,4-difluorophenylamine is 208.00 g/mol.

When was 5-Bromo-2,4-difluorophenylamine created and modified?

5-Bromo-2,4-difluorophenylamine was created on July 19, 2005, and last modified on December 2, 2023.

What is the IUPAC name of 5-Bromo-2,4-difluorophenylamine?

The IUPAC name of 5-Bromo-2,4-difluorophenylamine is 5-bromo-2,4-difluoroaniline.

What is the InChI of 5-Bromo-2,4-difluorophenylamine?

The InChI of 5-Bromo-2,4-difluorophenylamine is InChI=1S/C6H4BrF2N/c7-3-1-6(10)5(9)2-4(3)8/h1-2H,10H2.

What is the InChIKey of 5-Bromo-2,4-difluorophenylamine?

The InChIKey of 5-Bromo-2,4-difluorophenylamine is FQZCUAASVCIWSL-UHFFFAOYSA-N.

What is the Canonical SMILES of 5-Bromo-2,4-difluorophenylamine?

The Canonical SMILES of 5-Bromo-2,4-difluorophenylamine is C1=C(C(=CC(=C1Br)F)F)N.

What is the XLogP3-AA of 5-Bromo-2,4-difluorophenylamine?

The XLogP3-AA of 5-Bromo-2,4-difluorophenylamine is 2.1.

How many hydrogen bond donor count does 5-Bromo-2,4-difluorophenylamine have?

5-Bromo-2,4-difluorophenylamine has one hydrogen bond donor count.

Upstream Synthesis Route 1

  • 345-24-4
  • 452-92-6

Reference: [1] Journal of Medicinal Chemistry, 2007, vol. 50, # 16, p. 3870 - 3882
[2] Patent: WO2004/5257, 2004, A1, . Location in patent: Page 67-68
[3] Journal of the American Chemical Society, 1956, vol. 78, p. 2593,2596

Upstream Synthesis Route 2

  • 348-57-2
  • 452-92-6

Reference: [1] Journal of Medicinal Chemistry, 2007, vol. 50, # 16, p. 3870 - 3882
[2] Journal of the American Chemical Society, 1956, vol. 78, p. 2593,2596

Upstream Synthesis Route 3

  • 345-24-4
  • 452-92-6

Reference: [1]Patent: CN110483366,2019,A .Location in patent: Paragraph 0727; 0733-0735

Downstream Synthesis Route 1

  • 452-92-6
  • 1160789-91-2

Reference: [1] Patent: US2013/252938, 2013, A1,

Downstream Synthesis Route 2

  • 452-92-6
  • 90-02-8
  • 1016234-69-7

Reference: [1]Patent: US2008/90804,2008,A1 .Location in patent: Page/Page column 5

Downstream Synthesis Route 3

  • 452-92-6
  • 79-30-1
  • 762297-97-2

Reference: [1]Journal of Medicinal Chemistry,2007,vol. 50,p. 3870 - 3882

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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