| CAS Number | 343247-57-4 |
| Catalog Number | AG019WG3(AGN-PC-02U3AB) |
| Chemical Name | (3-Chloro-4-fluorophenyl)urea |
| IUPAC Name | (3-chloro-4-fluorophenyl)urea |
| InChI | InChI=1S/C7H6ClFN2O/c8-5-3-4(11-7(10)12)1-2-6(5)9/h1-3H,(H3,10,11,12) |
| InChI Key | PAIOBGQOUSRSNN-UHFFFAOYSA-N |
| MDL Number | MFCD11183381 |
| Molecular Formula | C7H6ClFN2O |
| Molecular Weight | 188.5867 |
| SMILES | NC(NC1=CC(Cl)=C(F)C=C1)=O |
| Synonyms | (3-chloro-4-fluorophenyl)urea,
1-(3-chloro-4-fluorophenyl)urea,
343247-57-4,
AC1Q4ZV2,
SCHEMBL6829796,
CTK1B1242,
DTXSID50608151,
n-(3-chloro-4-fluorophenyl)urea,
Urea, (3-chloro-4-fluorophenyl)-,
BBL004585,
MFCD11183381,
STL124186,
ZINC20362169,
AKOS005716789,
MCULE-3379878968,
H5389,
EN300-51845,
AB01005455-01,
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| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.586g/mol |
| Monoisotopic Mass | 188.015g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number