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CAS Number: 28478-46-8
methyl 4-hydroxy-2-methoxybenzoate

Structure

methyl 4-hydroxy-2-methoxybenzoate
Name: methyl 4-hydroxy-2-methoxybenzoate
Synonyms:
General Information
Product Number: 28478468
CAS Registry Number: 28478-46-8
Name:
        Benzoic acid, 4-​hydroxy-​2-​methoxy-​, methyl ester
        o-​Anisic acid, 4-​hydroxy-​, methyl ester (8CI); 4-​Hydroxy-​2-​methoxybenzoic acid methyl ester; Methyl 4-​hydroxy-​2-​methoxybenzoate; Methyl 4-​hydroxy-​o-​anisate 
 
Chemical Formula: C9H10O4
Exact Mass: 182.06
Molecular Weight: 182.17
m/z: 182.06 (100.0%), 183.06 (10.0%), 184.06 (1.2%)
Elemental Analysis: C, 59.34; H, 5.53; O, 35.13
 
InChI: InChI=1S/C9H10O4/c1-12-8-5-6(10)3-4-7(8)9(11)13-2/h3-5,10H,1-2H3
InChIKey: KCWJRQPHPPKPBK-UHFFFAOYSA-N
Canonical SMILES : COC1=C(C=CC(=C1)O)C(=O)OC
 
Thermal Properties Value Condition Note
Melting Point 150-151 °C   (1)IC
Melting Point 137-140 °C   (2)IC
Melting Point 110 °C   (3)CAS

Specification

98%

References
  1. (1) Danishefsky, Samuel; Journal of the American Chemical Society 1979, V101(23), P7001-8 CAPLUS
  2. (2) Robertson, David W.; Journal of Medicinal Chemistry 1985, V28(6), P717-27 CAPLUS
  3. (3) Trave, Roberto; Rend. ist. lombardo sci., Pt. I., Classe sci. mat. e nat. 1960, V94A, P273-88 CAPLUS
  4. (4) Piao, Yuan Zhe; Journal of Agricultural and Food Chemistry 2009, V57(21), P10004-10013 CAPLUS
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