| CAS Number | 1094363-64-0 |
| Catalog Number | AG019L0D |
| Chemical Name | 3-(2-Chloropropanoyl)-1-(2-fluorophenyl)urea |
| IUPAC Name | 2-chloro-N-[(2-fluorophenyl)carbamoyl]propanamide |
| InChI | InChI=1S/C10H10ClFN2O2/c1-6(11)9(15)14-10(16)13-8-5-3-2-4-7(8)12/h2-6H,1H3,(H2,13,14,15,16) |
| InChI Key | XMHPNSLHYGRMOM-UHFFFAOYSA-N |
| MDL Number | MFCD11185281 |
| Molecular Formula | C10H10ClFN2O2 |
| Molecular Weight | 244.6500 |
| SMILES | CC(C(NC(NC1=C(F)C=CC=C1)=O)=O)Cl |
| Synonyms | 3-(2-chloropropanoyl)-1-(2-fluorophenyl)urea,
1094363-64-0,
AKOS009147134,
NE15071,
EN300-29342,
|
| Complexity | 276 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.65g/mol |
| Monoisotopic Mass | 244.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number