| CAS Number | 87119-12-8 |
| Catalog Number | AG004OWO(AGN-PC-02Q7T8) |
| Chemical Name | 2-fluoro-4-isopropylaniline |
| IUPAC Name | 2-fluoro-4-propan-2-ylaniline |
| InChI | InChI=1S/C9H12FN/c1-6(2)7-3-4-9(11)8(10)5-7/h3-6H,11H2,1-2H3 |
| InChI Key | UHLWQRYLMMKFRU-UHFFFAOYSA-N |
| MDL Number | MFCD08275299 |
| Molecular Formula | C9H12FN |
| Molecular Weight | 153.1967 |
| SMILES | FC1=C(N)C=CC(=C1)C(C)C |
| Synonyms | 2-FLUORO-4-ISOPROPYLANILINE,
87119-12-8,
2-Fluoro-4-(propan-2-yl)aniline,
SCHEMBL4826032,
CTK5F7856,
DTXSID10601688,
MFCD08275299,
ZINC39103220,
AKOS013203820,
Benzenamine, 2-fluoro-4-(1-methylethyl)- (9CI),
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| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.2g/mol |
| Monoisotopic Mass | 153.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number