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CAS Number: 36873-96-8
2,3,5-trimethoxybenzoic acid

Structure

2,3,5-trimethoxybenzoic acid
Name: 2,3,5-trimethoxybenzoic acid
Synonyms:
General Information
Product Number: 36873968

CAS Registry Number 36873-96-8
Name:
Benzoic acid, 2,​3,​5-​trimethoxy-
2,3,5-Trimethoxybenzoic acid

 

Chemical Formula: C10H12O5
Exact Mass: 212.07
Molecular Weight: 212.20
m/z: 212.07 (100.0%), 213.07 (11.1%), 214.07 (1.0%)

 

InChI:InChI=1S/C10H12O5/c1-13-6-4-7(10(11)12)9(15-3)8(5-6)14-2/h4-5H,1-3H3,(H,11,12)

InChI Key:SRLTVIITBRPPCB-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 141-143 °C   (1)CAS
Melting Point 105 °C   (2)CAS
Melting Point 105 °C   (3)CAS
Melting Point 99-101 °C   (4)CAS
Melting Point 98-100 °C   (5)CAS
Melting Point 98-99 °C   (6)CAS

Specification

98%

References
  1. (1) Faltis, Franz; Monatshefte fuer Chemie 1922, V42, P311-76 CAPLUS
  2. (2) Smith, L. E.; Journal of the American Chemical Society 1931, V53, P3072-7 CAPLUS
  3. (3) Horii, Zenichi; Yakugaku Zasshi 1952, V72, P1520-2 CAPLUS
  4. (4) Rabjohn, Norman; Journal of Organic Chemistry 1956, V21, P218-19 CAPLUS
  5. (5) Murakami, Masuo; Proceedings of the Imperial Academy (Tokyo) 1931, V7, P254-7 CAPLUS
  6. (6) Murakami, Masuo; Nippon Kagaku Kaishi (1921-47) 1932, V53, P150-61,162-80 CAPLUS
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