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Structure

Benzaldehyde,3-bromo-4,5-dihydroxy-

CAS
16414-34-9
Catalog Number
ACM16414349
Category
Other Products
Molecular Weight
217.02
Molecular Formula
C7H5BrO3

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Specification

Synonyms
3-bromo-4,5-dihydroxybenzaldehyde;
IUPAC Name
3-bromo-4,5-dihydroxybenzaldehyde
Canonical SMILES
C1=C(C=C(C(=C1O)O)Br)C=O
InChI Key
GVSGSHGXUXLQNS-UHFFFAOYSA-N
Boiling Point
297.4ºC at 760mmHg
Flash Point
133.7ºC
Density
1.901g/cm³
Appearance
Light yellow powder
EC Number
240-463-8
Exact Mass
215.94200
H-Bond Acceptor
3
H-Bond Donor
2

Upstream Synthesis Route 1

  • 139-85-5
  • 16414-34-9

Reference: [1]Bailey, Karl L.; Molinski, Tadeusz F.
[Tetrahedron Letters, 2002, vol. 43, # 52, p. 9657 - 9661]

Downstream Synthesis Route 1

  • 16414-34-9
  • 52783-66-1

Reference: [1] Bulletin des Societes Chimiques Belges, 1974, vol. 83, # 3-4, p. 117 - 124
[2] Bulletin des Societes Chimiques Belges, 1974, vol. 83, # 3-4, p. 117 - 124

Downstream Synthesis Route 2

  • 16414-34-9
  • 52897-61-7

Reference: [1]Sudalai, A.; Rao, G. S. Krishna
[Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1989, vol. 28, # 1-11, p. 858 - 859]
[2]Shoeib, Nagwa A.; Bibby, Michael C.; Blunden, Gerald; Linley, Peter A.; Swaine, David J.; Wheelhouse, Richard T.; Wright, Colin W.
[Journal of Natural Products, 2004, vol. 67, # 9, p. 1445 - 1449]

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

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