| CAS Number | 2089378-62-9 |
| Catalog Number | AG01DU6G |
| Chemical Name | 4-(Trifluoromethoxy)indan-1-amine hydrochloride |
| IUPAC Name | 4-(trifluoromethoxy)-2,3-dihydro-1H-inden-1-amine;hydrochloride |
| InChI | InChI=1S/C10H10F3NO.ClH/c11-10(12,13)15-9-3-1-2-6-7(9)4-5-8(6)14;/h1-3,8H,4-5,14H2;1H |
| InChI Key | XVVOVEJDWGMYRJ-UHFFFAOYSA-N |
| MDL Number | MFCD28975214 |
| Molecular Formula | C10H11ClF3NO |
| Molecular Weight | 253.6486 |
| SMILES | NC1CCC2=C1C=CC=C2OC(F)(F)F.[H]Cl |
| Synonyms | 4-(Trifluoromethoxy)-2,3-dihydro-1H-inden-1-amine hydrochloride,
2089378-62-9,
KS-00000U9Q,
AKOS030633054,
AK684511,
PC449026,
4-(Trifluoromethoxy)indan-1-amine hydrochloride,
2,3-DIHYDRO-4-(TRIFLUOROMETHOXY)-1H-INDEN-1-AMINE hydrochloride,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.649g/mol |
| Monoisotopic Mass | 253.048g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number