| CAS Number | 191608-23-8 |
| Catalog Number | AG01BACC(AGN-PC-0O66KT) |
| Chemical Name | 7-chloro-3,4-dihydro-2H-1-benzopyran-4-amine hydrochloride |
| IUPAC Name | 7-chloro-3,4-dihydro-2H-chromen-4-amine;hydrochloride |
| InChI | InChI=1S/C9H10ClNO.ClH/c10-6-1-2-7-8(11)3-4-12-9(7)5-6;/h1-2,5,8H,3-4,11H2;1H |
| InChI Key | MUKIHNNHMAAWPC-UHFFFAOYSA-N |
| MDL Number | MFCD28397595 |
| Molecular Formula | C9H11Cl2NO |
| Molecular Weight | 220.0957 |
| SMILES | NC1CCOC2=CC(Cl)=CC=C12.Cl |
| Synonyms | 191608-23-8,
7-chloro-3,4-dihydro-2H-1-benzopyran-4-amine hydrochloride,
7-CHLOROCHROMAN-4-AMINE HCL,
(R)-7-CHLOROCHROMAN-4-AMINE HCL,
(S)-7-CHLOROCHROMAN-4-AMINE HCL,
Z2044769360,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.093g/mol |
| Monoisotopic Mass | 219.022g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number