| CAS Number | 1021001-13-7 |
| Catalog Number | AG019ZNK |
| Chemical Name | 1-(2,4-Difluorophenyl)-2-methylpropan-1-amine |
| IUPAC Name | 1-(2,4-difluorophenyl)-2-methylpropan-1-amine |
| InChI | InChI=1S/C10H13F2N/c1-6(2)10(13)8-4-3-7(11)5-9(8)12/h3-6,10H,13H2,1-2H3 |
| InChI Key | LGCSZOFAQLXAQA-UHFFFAOYSA-N |
| MDL Number | MFCD11148450 |
| Molecular Formula | C10H13F2N |
| Molecular Weight | 185.2137 |
| SMILES | CC(C(C1=C(F)C=C(F)C=C1)N)C |
| Synonyms | 1-(2,4-difluorophenyl)-2-methylpropan-1-amine,
1021001-13-7,
AKOS000244525,
AKOS022475241,
MCULE-6896131061,
NE38817,
Z1413780550,
RP24533,
(1R)-1-(2,4-DIFLUOROPHENYL)-2-METHYLPROPYLAMINE,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.101606g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.21g/mol |
| Monoisotopic Mass | 185.101606g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number