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CAS Number: 6342-72-9
dimethyl 2-hydroxyterephthalate

Structure

dimethyl 2-hydroxyterephthalate
Name: dimethyl 2-hydroxyterephthalate
Synonyms:
General Information
Product Number: 6342729
CAS Registry Number: 6342-72-9
Name:
        1,​4-​Benzenedicarboxylic acid, 2-​hydroxy-​, 1,​4-​dimethyl ester
        1,​4-​Benzenedicarboxylic acid, 2-​hydroxy-​, dimethyl ester (9CI); Terephthalic acid, hydroxy-​, dimethyl ester (7CI); 2-​Hydroxyterephthalic acid dimethyl ester; Dimethyl 2-​hydroxyterephthalate; Dimethyl hydroxyterephthalate; Hydroxyterephthalic acid dimethyl ester; NSC 46640 
 
Chemical Formula: C10H10O5
Exact Mass: 210.05
Molecular Weight: 210.18
m/z: 210.05 (100.0%), 211.06 (11.1%), 212.06 (1.6%)
Elemental Analysis: C, 57.14; H, 4.80; O, 38.06
 
InChI: InChI=1S/C10H10O5/c1-14-9(12)6-3-4-7(8(11)5-6)10(13)15-2/h3-5,11H,1-2H3
InChIKey: CJOJIAKIRLKBOO-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC(=C(C=C1)C(=O)OC)O
 
Thermal Properties Value Condition Note
Melting Point 94-95 °C   (4)CAS
Melting Point 94 °C   (5)CAS
Melting Point 92-93 °C   (6)CAS
Melting Point 92-92.5 °C   (2)IC
Melting Point 85-87 °C   (1)CAS
Melting Point 82-83 °C Solv: methanol (67-56-1) (2)IC

Specification

98%

References
  1. (1) Shkoor, Mohanad; European Journal of Organic Chemistry 2010, (19), P3732-3742 CAPLUS
  2. (2) Kulanthaivel, Palaniappan; Journal of Natural Products 1988, V51(2), P379-81 CAPLUS
  3. (3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  4. (4) Chen, Yiwang; Polymer 2003, V44(19), P5513-5520 CAPLUS
  5. (5) Kuhn, Richard; Chemische Berichte 1950, V83, P304-9 CAPLUS
  6. (6) Schulz, Leo; Ber. Schimmel & Co. Akt.-Ges. 1940, P51-4 CAPLUS
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