| CAS Number | 1803601-06-0 |
| Catalog Number | AG00ILFJ(AGN-PC-0WG3GF) |
| Chemical Name | 3-(trifluoromethyl)cyclobutan-1-amine hydrochloride |
| IUPAC Name | 3-(trifluoromethyl)cyclobutan-1-amine;hydrochloride |
| InChI | InChI=1S/C5H8F3N.ClH/c6-5(7,8)3-1-4(9)2-3;/h3-4H,1-2,9H2;1H |
| InChI Key | CSLJNSSCBKHZQN-UHFFFAOYSA-N |
| MDL Number | MFCD28714563 |
| Molecular Formula | C5H9ClF3N |
| Molecular Weight | 175.5799 |
| SMILES | Cl.FC(C1CC(C1)N)(F)F |
| Synonyms | 3-(trifluoromethyl)cyclobutan-1-amine hydrochloride,
1803601-06-0,
cis-3-(Trifluoromethyl)cyclobutan-1-amine hydrochloride,
trans-3-(Trifluoromethyl)cyclobutan-1-amine hydrochloride,
2227198-22-1,
2227198-26-5,
SB18631,
AS-51236,
CS-0051645,
3-(trifluoromethyl)cyclobutan-1-amine,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.579g/mol |
| Monoisotopic Mass | 175.038g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number