| CAS Number | 1090829-74-5 |
| Catalog Number | AG01ELQ2 |
| Chemical Name | 3-fluoro-N,4-dimethylbenzamide |
| IUPAC Name | 3-fluoro-N,4-dimethylbenzamide |
| InChI | InChI=1S/C9H10FNO/c1-6-3-4-7(5-8(6)10)9(12)11-2/h3-5H,1-2H3,(H,11,12) |
| InChI Key | GXYKESMXHVNYNW-UHFFFAOYSA-N |
| MDL Number | MFCD11767632 |
| Molecular Formula | C9H10FNO |
| Molecular Weight | 167.1802 |
| SMILES | CNC(C1=CC(F)=C(C)C=C1)=O |
| Synonyms | SCHEMBL1441177,
3-fluoro-N,4-dimethylbenzamide,
AKOS009056321,
MCULE-7137351892,
1090829-74-5,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.183g/mol |
| Monoisotopic Mass | 167.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number