| CAS Number | 1267772-25-7 |
| Catalog Number | AG01C6LZ |
| Chemical Name | 6,7-difluoro-3,4-dihydro-2H-1,4-benzoxazine |
| IUPAC Name | 6,7-difluoro-3,4-dihydro-2H-1,4-benzoxazine |
| InChI | InChI=1S/C8H7F2NO/c9-5-3-7-8(4-6(5)10)12-2-1-11-7/h3-4,11H,1-2H2 |
| InChI Key | FGEDESOVQJKVCJ-UHFFFAOYSA-N |
| MDL Number | MFCD19374571 |
| Molecular Formula | C8H7F2NO |
| Molecular Weight | 171.1441 |
| SMILES | FC1=C(F)C=C2C(NCCO2)=C1 |
| Synonyms | 1267772-25-7,
6,7-Difluoro-3,4-dihydro-2H-benzo[b][1,4]oxazine,
6,7-difluoro-3,4-dihydro-2H-1,4-benzoxazine,
MFCD19374571,
ZINC62498576,
AKOS022468334,
AS-36300,
Z2467454623,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.147g/mol |
| Monoisotopic Mass | 171.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number