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Structure

4(1H)-Cinnolinone

CAS
18514-84-6
Catalog Number
ACM18514846
Category
Other Products
Molecular Weight
146.14604
Molecular Formula
C8H6 N2 O

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Specification

Synonyms
1H-CINNOLIN-4-ONE;[1,8]NAPHTHYRIDIN-4-OL
IUPAC Name
1H-cinnolin-4-one
Canonical SMILES
C1=CC=C2C(=C1)C(=O)C=NN2
InChI Key
UFMBERDMCRCVSM-UHFFFAOYSA-N
Boiling Point
303.5ºC at 760 mmHg
Flash Point
137.3ºC
Density
1.31 g/cm³
Exact Mass
146.04800
H-Bond Acceptor
3
H-Bond Donor
1

Upstream Synthesis Route 1

  • 551-93-9
  • 18514-84-6

Reference: [1] Heterocycles, 2008, vol. 75, # 1, p. 77 - 86
[2] Australian Journal of Chemistry, 1981, vol. 34, # 12, p. 2619 - 2627
[3] Patent: WO2009/53799, 2009, A1, . Location in patent: Page/Page column 28-29
[4] Journal of the Chemical Society, 1947, p. 917,920

Upstream Synthesis Route 2

  • 109773-41-3
  • 18514-84-6

Reference: [1] Synthesis, 1987, # 3, p. 288 - 290

Downstream Synthesis Route 1

  • 18514-84-6
  • 253-66-7

Reference: [1] Journal of the Chemical Society, 1959, p. 2858,2861

Downstream Synthesis Route 2

  • 186581-53-3
  • 18514-84-6
  • 1556-22-5
  • 4964-44-7

Reference: [1]Journal of the Chemical Society,1963,p. 4924,4928

Downstream Synthesis Route 3

  • 186581-53-3
  • 18514-84-6
  • 4964-44-7

Reference: [1]Journal of the Chemical Society,1963,p. 4924,4928

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

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