| CAS Number | 144851-84-3 |
| Catalog Number | AG00ABV6(AGN-PC-02D9IL) |
| Chemical Name | Ethyl 2-amino-3-fluorobenzoate |
| IUPAC Name | ethyl 2-amino-3-fluorobenzoate |
| InChI | InChI=1S/C9H10FNO2/c1-2-13-9(12)6-4-3-5-7(10)8(6)11/h3-5H,2,11H2,1H3 |
| InChI Key | QMEOQULTCQLTGQ-UHFFFAOYSA-N |
| MDL Number | MFCD10566815 |
| Molecular Formula | C9H10FNO2 |
| Molecular Weight | 183.1796 |
| SMILES | CCOC(C1=C(N)C(F)=CC=C1)=O |
| Synonyms | ETHYL 2-AMINO-3-FLUOROBENZOATE,
144851-84-3,
SCHEMBL8758926,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.182g/mol |
| Monoisotopic Mass | 183.07g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number