| CAS Number | 95825-88-0 |
| Catalog Number | AG01AC2Z(AGN-PC-00MMLK) |
| Chemical Name | 3,4-Diethoxy-2-fluoroaniline |
| IUPAC Name | 3,4-diethoxy-2-fluoroaniline |
| InChI | InChI=1S/C10H14FNO2/c1-3-13-8-6-5-7(12)9(11)10(8)14-4-2/h5-6H,3-4,12H2,1-2H3 |
| InChI Key | UPCYUUBWAKJWEC-UHFFFAOYSA-N |
| MDL Number | MFCD26407845 |
| Molecular Formula | C10H14FNO2 |
| Molecular Weight | 199.2221 |
| SMILES | CCOC1=C(OCC)C(F)=C(N)C=C1 |
| Synonyms | 3,4-Diethoxy-2-fluoroaniline,
95825-88-0,
Benzenamine, 3,4-diethoxy-2-fluoro-,
ACMC-20m0aj,
2-Fluoro-3,4-diethoxyaniline,
SCHEMBL10909552,
CTK3F3294,
DTXSID20541283,
UPCYUUBWAKJWEC-UHFFFAOYSA-N,
ZINC39649333,
AKOS022646159,
MCULE-1550061037,
Z1694645624,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.225g/mol |
| Monoisotopic Mass | 199.101g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number