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Structure

2,6-Dichloro-3-cyano-5-fluoropyridine

CAS
82671-02-1
Catalog Number
ACM82671021
Category
Other Products
Molecular Weight
190.99
Molecular Formula
C6HCl2N2F

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Specification

Synonyms
422169_ALDRICH, ZINC00396067, CID2733849, 2,6-Dichloro-3-cyano-5-fluoropyridine, 2,6-Dichloro-5-fluoro-3-nicotinonitrile, 2,6-Dichloro-5-fluoro-3-pyridinecarbonitrile, 82671-02-1
IUPAC Name
2,6-dichloro-5-fluoropyridine-3-carbonitrile
Canonical SMILES
C1=C(C(=NC(=C1F)Cl)Cl)C#N
InChI Key
DEDKKOOGYIMMBC-UHFFFAOYSA-N
Boiling Point
267.8ºC at 760 mmHg
Melting Point
89-91ºC
Flash Point
115.8ºC
Density
1.58 g/cm³
Appearance
off-white to light tan crystalline solid
Exact Mass
189.95000
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
Safety Description
26-36
WGK Germany
3

Upstream Synthesis Route 1

  • 113237-18-6
  • 82671-02-1

Reference: [1] Patent: US5739342, 1998, A,

Upstream Synthesis Route 2

  • 113237-18-6
  • 107-06-2
  • 82671-02-1

Reference: [1] Patent: US5739342, 1998, A,

Upstream Synthesis Route 3

  • 75993-41-8
  • 82671-02-1

Reference: [1] Chemical and Pharmaceutical Bulletin, 1987, vol. 35, # 6, p. 2280 - 2285

Downstream Synthesis Route 1

  • 82671-02-1
  • 82671-06-5

Reference: [1]Chemical and Pharmaceutical Bulletin,1990,vol. 38,p. 3211 - 3217
[2]Patent: US4649144,1987,A
[3]Patent: EP333020,1991,A3

Downstream Synthesis Route 2

  • 82671-02-1
  • 113237-20-0

Reference: [1]Patent: CN108690016,2018,A .Location in patent: Paragraph 0366; 0368; 0369

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

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