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Structure

9H-Purin-6-amine,8-bromo-

CAS
6974-78-3
Catalog Number
ACM6974783
Category
Other Products
Molecular Weight
214.02
Molecular Formula
C5H4BrN5

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Specification

Synonyms
8-Bromo-Adenine; 6-Amino-8-bromopurine; 8-bromo-1h-purin-6-amine; EINECS 230-225-1; 8-Bromo-9H-purin-6-ylamine; 8-Bromo-9H-purin-6-amine; 8-Br-adenine; 8-Bromo-1H-adenine;
IUPAC Name
8-bromo-7H-purin-6-amine
Canonical SMILES
C1=NC2=C(C(=N1)N)NC(=N2)Br
InChI Key
FVXHPCVBOXMRJP-UHFFFAOYSA-N
Boiling Point
497.5ºC
Flash Point
254.7ºC
Density
2.14 g/cm³
EC Number
230-225-1
Exact Mass
212.96500
H-Bond Acceptor
4
H-Bond Donor
2

Upstream Synthesis Route 1

  • 66224-66-6
  • 6974-78-3

Reference: [1] Patent: CN108503643, 2018, A, . Location in patent: Paragraph 0023; 0036; 0037; 0038

Upstream Synthesis Route 2

  • 14985-44-5
  • 60-24-2
  • 31077-24-4
  • 6974-78-3

Reference: [1] Tetrahedron Letters, 2006, vol. 47, # 5, p. 711 - 714

Upstream Synthesis Route 3

  • 6000-44-8
  • 2946-39-6
  • 87650-99-5
  • 6974-78-3

Reference: [1] Tetrahedron Letters, 1983, vol. 24, # 34, p. 3571 - 3572
[2] Tetrahedron Letters, 1983, vol. 24, # 34, p. 3571 - 3572

Downstream Synthesis Route 1

  • 542-69-8
  • 6974-78-3
  • 202136-43-4

Reference: [1]Journal of Medicinal Chemistry,2006,vol. 49,p. 817 - 828

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

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