| CAS Number | 160358-04-3 |
| Catalog Number | AG01AJHS(AGN-PC-02T60O) |
| Chemical Name | 2-(3-Fluorophenyl)-2-methylpropan-1-amine |
| IUPAC Name | 2-(3-fluorophenyl)-2-methylpropan-1-amine |
| InChI | InChI=1S/C10H14FN/c1-10(2,7-12)8-4-3-5-9(11)6-8/h3-6H,7,12H2,1-2H3 |
| InChI Key | UOESZEQYGLLTRN-UHFFFAOYSA-N |
| MDL Number | MFCD11052145 |
| Molecular Formula | C10H14FN |
| Molecular Weight | 167.2233 |
| SMILES | CC(C1=CC(F)=CC=C1)(CN)C |
| Synonyms | 2-(3-fluorophenyl)-2-methylpropan-1-amine,
160358-04-3,
2-(3-FLUORO-PHENYL)-2-METHYL-PROPYLAMINE,
SCHEMBL2260664,
CTK7E2752,
ZINC14000271,
AKOS000302400,
MCULE-2232759545,
NE14854,
AJ-64571,
TR-056743,
EN300-80800,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.227g/mol |
| Monoisotopic Mass | 167.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number