| CAS Number | 946612-94-8 |
| Catalog Number | AG01BGTS |
| Chemical Name | (4-fluoro-2-methylphenyl)thiourea |
| IUPAC Name | (4-fluoro-2-methylphenyl)thiourea |
| InChI | InChI=1S/C8H9FN2S/c1-5-4-6(9)2-3-7(5)11-8(10)12/h2-4H,1H3,(H3,10,11,12) |
| InChI Key | PPTASGUYMCEEOJ-UHFFFAOYSA-N |
| MDL Number | MFCD00041181 |
| Molecular Formula | C8H9FN2S |
| Molecular Weight | 184.2339 |
| SMILES | CC1=C(NC(N)=S)C=CC(F)=C1 |
| Synonyms | (4-fluoro-2-methylphenyl)thiourea,
946612-94-8,
(4-Fluoro-2-methyl-phenyl)-thiourea,
SCHEMBL5525050,
ZINC20368744,
1-(4-fluoro-2-methylphenyl)thiourea,
AKOS009155072,
SC-64693,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.232g/mol |
| Monoisotopic Mass | 184.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number