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CAS Number: 71643-66-8
4-chloro-2-iodophenol

Structure

4-chloro-2-iodophenol
Name: 4-chloro-2-iodophenol
Synonyms:
General Information
Product Number: 71643668

CAS Registry Number 71643-66-8
Name:
Phenol, 4-​chloro-​2-​iodo-
2-Iodo-4-chlorophenol
4-Chloro-2-iodophenol

 

Chemical Formula: C6H4ClIO
Exact Mass: 253.90
Molecular Weight: 254.45
m/z: 253.90 (100.0%), 255.90 (32.2%), 254.90 (6.5%), 256.90 (2.1%)

 

InChI:InChI=1S/C6H4ClIO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

InChI Key:JKPLMQJLGBBFLO-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1Cl)I)O

 

Thermal Properties Value Condition Note
Melting Point 79-82 °C   (4)CAS
Melting Point 78 °C   (5)CAS
Melting Point 78 °C Solv: chloroform (67-66-3) (6)CAS
Melting Point 77 °C   (2)CAS
Melting Point 75.5-76.5 °C   (7)IC
Melting Point 75-77 °C   (8)CAS
Melting Point 75-77 °C   (9)CAS
Melting Point 75-77 °C   (10)CAS
Melting Point 75-76 °C   (1)CAS

Specification

98%

References
  1. (1) Bovonsombat, Pakorn; Tetrahedron Letters 2009, V50(22), P2664-2667 CAPLUS
  2. (2) Jaseer, E. A.; Tetrahedron 2010, V66(11), P2077-2082 CAPLUS
  3. (4) Mylari, Banavara L.; Journal of Medicinal Chemistry 2005, V48(20), P6326-6339 CAPLUS
  4. (5) Buchan, Samuel; Journal of the Chemical Society 1931, P137-44 CAPLUS
  5. (6) Varma, Phuldeo Sahay; Journal of the Indian Chemical Society 1939, V16, P477-8 CAPLUS
  6. (7) Edgar, Kevin J.; Journal of Organic Chemistry 1990, V55(18), P5287-91 CAPLUS
  7. (8) Bogdal, D.; Green Chemistry 2004, V6(2), P110-113 CAPLUS
  8. (9) da Frota, Livia C. R. M.; Journal of the Brazilian Chemical Society 2009, V20(10), P1916-1920 CAPLUS
  9. (10) Akhlaghinia, Batool; Journal of the Brazilian Chemical Society 2010, V21(1), P3-6 CAPLUS
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