| CAS Number | 1439902-32-5 |
| Catalog Number | AG01C5BA |
| Chemical Name | 1-(4-(Trifluoromethyl)Phenyl)Cyclobutanamine Hydrochloride |
| IUPAC Name | 1-[4-(trifluoromethyl)phenyl]cyclobutan-1-amine;hydrochloride |
| InChI | InChI=1S/C11H12F3N.ClH/c12-11(13,14)9-4-2-8(3-5-9)10(15)6-1-7-10;/h2-5H,1,6-7,15H2;1H |
| InChI Key | SDRPLEZUIVWRDN-UHFFFAOYSA-N |
| MDL Number | MFCD17392714 |
| Molecular Formula | C11H13ClF3N |
| Molecular Weight | 251.6758 |
| SMILES | Cl.NC1(C2=CC=C(C(F)(F)F)C=C2)CCC1 |
| Synonyms | 1439902-32-5,
1-[4-(Trifluoromethyl)phenyl]cyclobutan-1-amine hydrochloride,
1-(4-(Trifluoromethyl)phenyl)cyclobutanamine hydrochloride,
1-[4-(TRIFLUOROMETHYL)PHENYL]CYCLOBUTAN-1-AMINE HCL,
SCHEMBL18742568,
DTXSID10857244,
AKOS027444832,
KS-7905,
Z2526439822,
1-[4-(Trifluoromethyl)phenyl]cyclobutan-1-amine--hydrogen chloride (1/1),
1270577-37-1,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.677g/mol |
| Monoisotopic Mass | 251.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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