| CAS Number | 1113053-52-3 |
| Catalog Number | AG019RH9(AGN-PC-0WO3CU) |
| Chemical Name | 1-(Trifluoromethyl)cyclobutan-1-amine |
| IUPAC Name | 1-(trifluoromethyl)cyclobutan-1-amine |
| InChI | InChI=1S/C5H8F3N/c6-5(7,8)4(9)2-1-3-4/h1-3,9H2 |
| InChI Key | UYHQDFQKVUGCAQ-UHFFFAOYSA-N |
| MDL Number | MFCD17480485 |
| Molecular Formula | C5H8F3N |
| Molecular Weight | 139.1189 |
| SMILES | NC1(C(F)(F)F)CCC1 |
| Synonyms | 1-(trifluoromethyl)cyclobutan-1-amine,
1113053-52-3,
1-Trifluoromethyl-cyclobutylamine,
1-(Trifluoromethyl)cyclobutanamine,
1-trifluoromethylcyclobutanamine,
AC1Q50G0,
SCHEMBL1790446,
DTXSID00679139,
UYHQDFQKVUGCAQ-UHFFFAOYSA-N,
MFCD17480485,
ZINC57219005,
AKOS012863435,
1-(Trifluoromethyl)-1-cyclobutaneamine,
MCULE-3457139792,
BS-13142,
EN300-89716,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.121g/mol |
| Monoisotopic Mass | 139.061g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number