Product Number: 951826
CAS Registry Number 951-82-6
Name:
Benzeneacetic acid, 3,4,5-trimethoxy-
Acetic acid, (3,4,5-trimethoxyphenyl)- (6CI,7CI,8CI)
2-(3,4,5-Trimethoxyphenyl)acetic acid
3,4,5-Trimethoxybenzeneacetic acid
3,4,5-Trimethoxyphenylacetic acid
NSC 130961
Chemical Formula: C11H14O5
Exact Mass: 226.08
Molecular Weight: 226.23
m/z: 226.08 (100.0%), 227.09 (12.2%), 228.09 (1.7%)
InChI:InChI=1S/C11H14O5/c1-14-8-4-7(6-10(12)13)5-9(15-2)11(8)16-3/h4-5H,6H2,1-3H3,(H,12,13)
InChI Key:DDSJXCGGOXKGSJ-UHFFFAOYSA-N
Canonical SMILES:COC1=CC(=CC(=C1OC)OC)CC(=O)O
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
147-150 °C |
Solv: acetone (67-64-1); chloroform (67-66-3) |
(5)CAS |
| Melting Point |
121 °C |
|
(7)CAS |
| Melting Point |
120 °C |
|
(8)CAS |
| Melting Point |
119-120 °C |
Solv: water (7732-18-5) |
(9)CAS |
| Melting Point |
118-120 °C |
|
(10)CAS |
| Melting Point |
117-118 °C |
Solv: water (7732-18-5) |
(11)CAS |
|
.gif)