| CAS Number | 1443931-90-5 |
| Catalog Number | AG00ASBC |
| Chemical Name | (1S)-1-(3-fluoro-4-methylphenyl)propan-1-amine hydrochloride |
| IUPAC Name | (1S)-1-(3-fluoro-4-methylphenyl)propan-1-amine;hydrochloride |
| InChI | InChI=1S/C10H14FN.ClH/c1-3-10(12)8-5-4-7(2)9(11)6-8;/h4-6,10H,3,12H2,1-2H3;1H/t10-;/m0./s1 |
| InChI Key | CWKFVOFWZXWRDE-PPHPATTJSA-N |
| MDL Number | MFCD16294094 |
| Molecular Formula | C10H15ClFN |
| Molecular Weight | 203.6842 |
| SMILES | Cl.CC[C@@H](C1=CC(F)=C(C)C=C1)N |
| Synonyms | 1213853-34-9,
(S)-1-(3-Fluoro-4-methylphenyl)propan-1-amine hydrochloride,
(1S)-1-(3-fluoro-4-methylphenyl)propan-1-amine hydrochloride,
1443931-90-5,
DTXSID80704216,
AKOS015923300,
NE46458,
(1s)-1-(3-fluoro-4-methylphenyl)propylamine hydrochloride,
(1S)-1-(3-Fluoro-4-methylphenyl)propan-1-amine--hydrogen chloride (1/1),
ACN-055339,
(1S)-1-(3-FLUORO-4-METHYLPHENYL)PROPYLAMINE-HCl,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.685g/mol |
| Monoisotopic Mass | 203.088g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number