| CAS Number | 909563-22-0 |
| Catalog Number | AG019EZL(AGN-PC-0OMI8X) |
| Chemical Name | Methyl 4-amino-2-isopropoxybenzoate |
| IUPAC Name | methyl 4-amino-2-propan-2-yloxybenzoate |
| InChI | InChI=1S/C11H15NO3/c1-7(2)15-10-6-8(12)4-5-9(10)11(13)14-3/h4-7H,12H2,1-3H3 |
| InChI Key | OEBRPGGWVCHZQE-UHFFFAOYSA-N |
| MDL Number | MFCD24624427 |
| Molecular Formula | C11H15NO3 |
| Molecular Weight | 209.2417 |
| SMILES | COC(=O)c1ccc(cc1OC(C)C)N |
| Synonyms | Methyl 4-amino-2-isopropoxybenzoate,
909563-22-0,
4-amino-2-isopropoxy-benzoic acid methyl ester,
MFCD24624427,
AKOS030632913,
ZINC229312581,
AK601777,
DS-19728,
CS-0059762,
A1-07977,
ACN-052983,
methyl 4-amino-2-propan-2-yloxybenzoate,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.245g/mol |
| Monoisotopic Mass | 209.105g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number