| CAS Number | 306761-17-1 |
| Catalog Number | AG00BJC8(AGN-PC-0R641Q) |
| Chemical Name | 2-(3,4-Difluorophenyl)propan-2-amine |
| IUPAC Name | 2-(3,4-difluorophenyl)propan-2-amine |
| InChI | InChI=1S/C9H11F2N/c1-9(2,12)6-3-4-7(10)8(11)5-6/h3-5H,12H2,1-2H3 |
| InChI Key | BKEJWQVDJHFFAD-UHFFFAOYSA-N |
| MDL Number | MFCD13189642 |
| Molecular Formula | C9H11F2N |
| Molecular Weight | 171.1871 |
| SMILES | CC(N)(C1=CC=C(F)C(F)=C1)C |
| Synonyms | 2-(3,4-difluorophenyl)propan-2-amine,
306761-17-1,
SCHEMBL1240276,
BKEJWQVDJHFFAD-UHFFFAOYSA-N,
MFCD13189642,
ZINC36156242,
AKOS012097023,
AB68826,
MCULE-5653900647,
NE24137,
1-(3,4-difluorophenyl)-1-methylethylamine,
Benzenemethanamine, 3,4-difluoro-alpha,alpha-dimethyl-,
Z1350579458,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.191g/mol |
| Monoisotopic Mass | 171.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number