| CAS Number | 55239-51-5 |
| Catalog Number | AG01B1QF |
| Chemical Name | N-(4-Fluorophenyl)-N-methylcarbamoyl chloride |
| IUPAC Name | N-(4-fluorophenyl)-N-methylcarbamoyl chloride |
| InChI | InChI=1S/C8H7ClFNO/c1-11(8(9)12)7-4-2-6(10)3-5-7/h2-5H,1H3 |
| InChI Key | FHBDZQWYXALRHT-UHFFFAOYSA-N |
| MDL Number | MFCD23790240 |
| Molecular Formula | C8H7ClFNO |
| Molecular Weight | 187.5987 |
| SMILES | CN(C1=CC=C(F)C=C1)C(Cl)=O |
| Synonyms | N-(4-fluorophenyl)-N-methylcarbamoyl chloride,
55239-51-5,
SCHEMBL9960174,
ZINC86894199,
AKOS018445629,
NE32614,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.598g/mol |
| Monoisotopic Mass | 187.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number