Product Number: 7287403
CAS Registry Number 7287-40-3
Name:
3-Benzofurancarboxylic acid, 5-hydroxy-2-methyl-, ethyl ester
2-Methyl-3-carbethoxy-5-hydroxybenzofuran
2-Methyl-3-carboethoxy-5-ethoxybenzofuran
NSC 42354
Chemical Formula: C12H12O4
Exact Mass: 220.07
Molecular Weight: 220.22
m/z: 220.07 (100.0%), 221.08 (13.3%), 222.08 (1.6%)
InChI:InChI=1S/C12H12O4/c1-3-15-12(14)11-7(2)16-10-5-4-8(13)6-9(10)11/h4-6,13H,3H2,1-2H3
InChI Key:KSNVFCJUBJUTPF-UHFFFAOYSA-N
Canonical SMILES:CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)C
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
144 °C |
Solv: benzene (71-43-2) |
(1)CAS |
| Melting Point |
143-144 °C |
Solv: ethanol (64-17-5) |
(2)IC |
| Melting Point |
142-144 °C |
Solv: dichloromethane (75-09-2); acetone (67-64-1) |
(3)CAS |
| Melting Point |
137-138 °C |
|
(4)CAS |
| Melting Point |
137 °C |
|
(5)CAS |
|
(1) Domschke, Guenter; Journal fuer Praktische Chemie (Leipzig) 1966, V32(3-4), P140-3 CAPLUS
(2) McPherson, H. L.; Journal of Heterocyclic Chemistry 1978, V15(1), P43-8 CAPLUS
(3) Velezheva, Valeriya S.; Journal of Heterocyclic Chemistry 2006, V43(4), P873-879 CAPLUS
(4) Grinev, A. N.; Zhurnal Obshchei Khimii 1962, V32, P1948-51 CAPLUS
(5) Grinev, A. N.; Zhurnal Obshchei Khimii 1957, V27, P1087-9 CAPLUS
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