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Structure

Ethanone,1-(3-chloro-4-hydroxyphenyl)-

CAS
2892-29-7
Catalog Number
ACM2892297
Category
Other Products
Molecular Weight
170.593
Molecular Formula
C8H7 Cl O2

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Specification

Synonyms
ZINC00730510, CID1051514, ST5115048, 2892-29-7
IUPAC Name
1-(3-chloro-4-hydroxyphenyl)ethanone
Canonical SMILES
CC(=O)C1=CC(=C(C=C1)O)Cl
InChI Key
GMTSPBYBJKGPJF-UHFFFAOYSA-N
Boiling Point
313.2ºC at 760 mmHg
Melting Point
86-89ºC
Flash Point
143.2ºC
Density
1.298 g/cm³
Appearance
WHITE TO TAN SOLID, POWDER, CRYSTALS,CRYSTALLINE POWDER AND/OR CHUNKS
Exact Mass
170.01300
Hazard Statements
Xi,Xn
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
26-39

Upstream Synthesis Route 1

  • 4525-75-1
  • 3226-34-4
  • 2892-29-7

Reference: [1] European Journal of Medicinal Chemistry, 2012, vol. 58, p. 184 - 191
[2] Journal of the Indian Chemical Society, 1959, vol. 36, p. 784
[3] Journal of the Indian Chemical Society, 1959, vol. 36, p. 784
[4] Journal of Chemical Research, Miniprint, 1989, # 11, p. 2713 - 2739
[5] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 1, p. 132 - 140

Upstream Synthesis Route 2

  • 95-57-8
  • 3226-34-4
  • 2892-29-7

Reference: [1] European Journal of Medicinal Chemistry, 2012, vol. 58, p. 184 - 191
[2] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 1, p. 132 - 140

Upstream Synthesis Route 3

  • 4525-75-1
  • 3226-34-4
  • 2892-29-7

Reference: [1]European Journal of Medicinal Chemistry,2012,vol. 58,p. 184 - 191
[2]Journal of the Indian Chemical Society,1959,vol. 36,p. 784
[3]Journal of the Indian Chemical Society,1959,vol. 36,p. 784
[4]Journal of Chemical Research, Miniprint,1989,p. 2713 - 2739
[5]Bioorganic and Medicinal Chemistry,2015,vol. 23,p. 132 - 140

Upstream Synthesis Route 4

  • 4525-75-1
  • 2892-29-7

Reference: [1]Bioorganic and Medicinal Chemistry Letters,2001,vol. 11,p. 777 - 780

Downstream Synthesis Route 1

  • 120-57-0
  • 2892-29-7
  • 109892-10-6

Reference: [1]Journal of the Indian Chemical Society,1959,vol. 36,p. 726

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

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