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CAS Number: 37470-46-5
4-hydroxy-3-iodobenzoic acid

Structure

4-hydroxy-3-iodobenzoic acid
Name: 4-hydroxy-3-iodobenzoic acid
Synonyms:
General Information
Product Number: 37470465

CAS Registry Number 37470-46-5
Name:
Benzoic acid, 4-?hydroxy-?3-?iodo-
4-Hydroxy-3-iodobenzoic acid
3-Iodo-4-hydroxybenzoic acid

 

Chemical Formula: C7H5IO3
Exact Mass: 263.93
Molecular Weight: 264.02
m/z: 263.93 (100.0%), 264.93 (7.7%)

 

InChI:InChI=1S/C7H5IO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)

InChI Key:BJZXBZGGLXHODK-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1C(=O)O)I)O

 

Thermal Properties Value Condition Note
Melting Point 190-200 °C   (1)CAS
Melting Point 175-176 °C   (2)IC
Melting Point 175-176 °C Solv: hexane (110-54-3); toluene (108-88-3) (3)CAS
Melting Point 173 °C   (4)CAS
Melting Point 173 °C   (5)IC
Melting Point 172-175 °C   (6)CAS
Melting Point 171-174 °C   (7)CAS
Melting Point 169-173 °C Solv: ethanol (64-17-5) (8)IC

Specification

98%

References
  1. (1) Samson, Aurora M.; Univ. Philippines Natural and Applied Sci. Bull. 1934, V4, P149-54 CAPLUS
  2. (2) Edgar, Kevin J.; Journal of Organic Chemistry 1990, V55(18), P5287-91 CAPLUS
  3. (3) Yusubov, Mekhman S.; Synthetic Communications 2007, V37(8), P1259-1265 CAPLUS
  4. (4) Brenans, P.; Compt. rend. 1923, V177, P768-70 CAPLUS
  5. (5) Goulette, Gilbert; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques 1975, V281(13), P543-6 CAPLUS
  6. (6) King, L. Carroll; Journal of the American Chemical Society 1945, V67, P2089-92 CAPLUS
  7. (7) Akhlaghinia, Batool; Journal of the Brazilian Chemical Society 2010, V21(1), P3-6 CAPLUS
  8. (8) Katzenellenbogen, John A.; Journal of Labelled Compounds and Radiopharmaceuticals 1981, V18(6), P865-79 CAPLUS
  9. (9) Kammerer, Hermann; Chemische Berichte 1958, V91, P1376-9 CAPLUS
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