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CAS Number: 6110-37-8
methyl 2,4-dimethoxy-6-methylbenzoate

Structure

methyl 2,4-dimethoxy-6-methylbenzoate
Name: methyl 2,4-dimethoxy-6-methylbenzoate
Synonyms:
General Information
Product Number: 6110378
CAS Registry Number: 6110-37-8
Name:
Benzoic acid, 2,​4-​dimethoxy-​6-​methyl-​, methyl ester
o-​Toluic acid, 4,​6-​dimethoxy-​, methyl ester (7CI,​8CI); Methyl 2,​4-​dimethoxy-​6-​methylbenzoate; Methyl 4,​6-​dimethoxy-​o-​toluate; Methyl di-​O-​methylorsellinate 
 
Chemical Formula: C11H14O4
Exact Mass: 210.09
Molecular Weight: 210.23
m/z: 210.09 (100.0%), 211.09 (12.0%)
Elemental Analysis: C, 62.85; H, 6.71; O, 30.44
 
InChI: InChI=1S/C11H14O4/c1-7-5-8(13-2)6-9(14-3)10(7)11(12)15-4/h5-6H,1-4H3
InChIKey: QCEODMDPMRZZDI-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=CC(=C1C(=O)OC)OC)OC
 
Thermal Properties Value Condition Note
Boiling Point 135 °C Press: 10 Torr (1)IC
Melting Point 44-45 °C   (3)CAS
Melting Point 42-44 °C   (6)IC
Melting Point 41.6 °C   (5)CAS
Melting Point 41 °C   (4)CAS
Melting Point 39-40 °C   (8)CAS
Melting Point 39-40 °C   (9)CAS

Specification

98%

References
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  2. (2) Mondal, Mukulesh; Journal of Organic Chemistry 2007, V72(6), P2068-2076 CAPLUS
  3. (3) Gimbert, Yves; EP 1300403 A1 2003 CAPLUS
  4. (4) Arlt, Alexander; Synthesis 2010, (6), P917-922 CAPLUS
  5. (5) Drochner, Daniel; European Journal of Organic Chemistry 2007, (11), P1749-1758 CAPLUS
  6. (6) Solladie, Guy; Tetrahedron: Asymmetry 1990, V1(3), P187-98 CAPLUS
  7. (7) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  8. (8) Sperry, Jonathan; Synthesis 2009, (15), P2561-2569 CAPLUS
  9. (9) Wadsworth, Andrew D.; Synthesis 2010, (15), P2604-2608 CAPLUS
  10. (10) Baird, Lynton J.; Journal of Organic Chemistry 2009, V74(6), P2271-2277 CAPLUS
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