| CAS Number | 102034-49-1 |
| Catalog Number | AG0006FR(AGN-PC-0363Q3) |
| Chemical Name | 2-Amino-3-(2-fluoro-4,5-dihydroxyphenyl)propanoic acid |
| IUPAC Name | 2-amino-3-(2-fluoro-4,5-dimethoxyphenyl)propanoic acid |
| InChI | InChI=1S/C11H14FNO4/c1-16-9-4-6(3-8(13)11(14)15)7(12)5-10(9)17-2/h4-5,8H,3,13H2,1-2H3,(H,14,15) |
| InChI Key | DFOGJHFCUVXMFI-UHFFFAOYSA-N |
| MDL Number | MFCD08669846 |
| Molecular Formula | C9H10FNO4 |
| Molecular Weight | 215.1784 |
| SMILES | NC(C(=O)O)CC1=C(C=C(C(=C1)O)O)F |
| Synonyms | 102034-49-1,
Tyrosine,2-fluoro-5-hydroxy-,
2-Fluoro-5-methoxy-O-methyltyrosine,
ACMC-1BSCY,
CTK4A0616,
DTXSID80698500,
AKOS030255631,
FT-0668649,
2-AMINO-3-(2-FLUORO-4,5-DIMETHOXYPHENYL)PROPANOIC ACID,
6-Fluoro DL-DOPA Hydrobromide Salt,
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| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.234g/mol |
| Monoisotopic Mass | 243.091g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 81.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number