starbld0027435
2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)acetic acid
Also Known As: starbld0027435|2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)acetic acid|2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)acetic acid|2-{4-methoxy-6-methyl-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl}acetic acid
CAS: 100719-12-8
| Molecular Formula | C14H17NO5 |
|---|---|
| Molecular Weight | 279.1107 g/mol |
| LogP | 1.4276 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.1107 |
| Monoisotopic Mass | 279.1107 |
| Heavy Atoms | 20 |
| Complexity | 556.98553 |
Chemical Identifiers
| CAS Number | 100719-12-8 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C(=C2C1CC(=O)O)OC)OCO3 |
Product Overview
starbld0027435 (CAS 100719-12-8), with molecular formula C14H17NO5 and molecular weight 279.1107 g/mol. IUPAC: 2-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)acetic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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