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CAS Number: 61203-48-3
2-iodo-4,5-dimethoxybenzoic acid

Structure

2-iodo-4,5-dimethoxybenzoic acid
Name: 2-iodo-4,5-dimethoxybenzoic acid
Synonyms:
General Information
Product Number: 61203483

CAS Registry Number 61203-48-3
Name:
Benzoic acid, 2-​iodo-​4,​5-​dimethoxy-
Veratric acid, 6-iodo- (7CI)
2-Iodo-4,5-dimethoxybenzoic acid
4,5-Dimethoxy-2-iodobenzoic acid

 

Chemical Formula: C9H9IO4
Exact Mass: 307.95
Molecular Weight: 308.07
m/z: 307.95 (100.0%), 308.96 (10.0%), 309.96 (1.3%)

 

InChI:InChI=1S/C9H9IO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,1-2H3,(H,11,12)

InChI Key:HLLHFIIJEOARHX-UHFFFAOYSA-N

Canonical SMILES:COC1=C(C=C(C(=C1)C(=O)O)I)OC

 

Thermal Properties Value Condition Note
Melting Point 310-314 °C   (3)CAS
Melting Point 197-200 °C   (1)CAS
Thermal Analysis See full text   (4)CAS

Specification

98%

References
  1. (1) Lv, Pei; Organic & Biomolecular Chemistry 2011, V9(9), P3133-3135 CAPLUS
  2. (3) Ruchelman, Alexander L.; Bioorganic & Medicinal Chemistry 2004, V12(13), P3731-3742 CAPLUS
  3. (4) Subramanian, Venkataraman; Journal of Organic Chemistry 2005, V70(12), P4778-4783 CAPLUS
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