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CAS Number: 73219-91-7
3,5-dichloro-2,6-dimethoxybenzoic acid

Structure

 3,5-dichloro-2,6-dimethoxybenzoic acid
Name: 3,5-dichloro-2,6-dimethoxybenzoic acid
Synonyms:
General Information
Product Number: 73219917

CAS Registry Number 73219-91-7
Name:
Benzoic acid, 3,?5-?dichloro-?2,?6-?dimethoxy-
3,5-Dichloro-2,6-dimethoxybenzoic acid

 

Chemical Formula: C9H8Cl2O4
Exact Mass: 249.98
Molecular Weight: 251.06
m/z: 249.98 (100.0%), 251.98 (64.7%), 253.97 (10.2%), 250.98 (9.9%), 252.98 (6.4%), 254.98 (1.1%)

 

InChI:InChI=1S/C9H8Cl2O4/c1-14-7-4(10)3-5(11)8(15-2)6(7)9(12)13/h3H,1-2H3,(H,12,13)

InChI Key:JPIAALCEQSLBKF-UHFFFAOYSA-N

Canonical SMILES:COC1=C(C(=C(C=C1Cl)Cl)OC)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 102.5-104.5 °C   (1)CAS
Melting Point 102-103 °C Solv: ligroine (8032-32-4) (2)IC
Melting Point 100-102 °C Solv: ligroine (8032-32-4) (3)IC
Melting Point See full text   (4)CAS

Specification

98%
References
  1. (1) GB 901553 1962 CAPLUS
  2. (2) Florvall, Lennart; Journal of Medicinal Chemistry 1982, V25(11), P1280-6 CAPLUS
  3. (3) Elix, John A.; Australian Journal of Chemistry 1990, V43(10), P1773-8 CAPLUS
  4. (4) Doyle, Frank P.; GB 920176 1963 CAPLUS
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