Product Number: 57009128
CAS Registry Number 57009-12-8
Name:
Benzoic acid, 3-acetyl-4-hydroxy-, methyl ester
4-Hydroxy-3-acetylbenzoic acid methyl ester
Methyl 3-acetyl-4-hydroxybenzoate
Chemical Formula: C10H10O4
Exact Mass: 194.06
Molecular Weight: 194.18
m/z: 194.06 (100.0%), 195.06 (11.1%), 196.06 (1.3%)
InChI:InChI=1S/C10H10O4/c1-6(11)8-5-7(10(13)14-2)3-4-9(8)12/h3-5,12H,1-2H3
InChI Key:FPYAQSSSRQZXMS-UHFFFAOYSA-N
Canonical SMILES:CC(=O)C1=C(C=CC(=C1)C(=O)OC)O
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
101-102 °C |
|
(1)CAS |
| Melting Point |
99-99.5 °C |
Solv: methanol (67-56-1); water (7732-18-5) |
(3)IC |
| Melting Point |
98-99 °C |
Solv: benzene (71-43-2) |
(5)CAS |
| Melting Point |
98 °C |
|
(6)CAS |
| Melting Point |
97 °C |
|
(2)IC |
| Melting Point |
96-97 °C |
Solv: methanol (67-56-1); water (7732-18-5) |
(7)IC |
|