| CAS Number | 623143-41-9 |
| Catalog Number | AG00ELJP(AGN-PC-0T3SU0) |
| Chemical Name | 1-(2,4-Difluorophenyl)propan-1-amine |
| IUPAC Name | 1-(2,4-difluorophenyl)propan-1-amine |
| InChI | InChI=1S/C9H11F2N/c1-2-9(12)7-4-3-6(10)5-8(7)11/h3-5,9H,2,12H2,1H3 |
| InChI Key | OPQILGGBYNHAGG-UHFFFAOYSA-N |
| MDL Number | MFCD11148452 |
| Molecular Formula | C9H11F2N |
| Molecular Weight | 171.1871 |
| SMILES | CCC(C1=C(F)C=C(F)C=C1)N |
| Synonyms | 1-(2,4-difluorophenyl)propan-1-amine,
623143-41-9,
SCHEMBL19438183,
MFCD11148452,
AKOS000244570,
AKOS022477506,
MCULE-7310070615,
NE14998,
EN300-81938,
A1-05268,
Z1250132461,
(R)-1-(2,4-DIFLUOROPHENYL)PROPAN-1-AMINE,
1217474-86-6,
|
| Complexity | 141 |
| 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 | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number