| CAS Number | 855222-36-5 |
| Catalog Number | AG00J3B6(AGN-PC-0WB6XC) |
| Chemical Name | 7-Chloro-2,3-dihydro-1,4-benzodioxin-6-amine hydrochloride |
| IUPAC Name | 6-chloro-2,3-dihydro-1,4-benzodioxin-7-amine;hydrochloride |
| InChI | InChI=1S/C8H8ClNO2.ClH/c9-5-3-7-8(4-6(5)10)12-2-1-11-7;/h3-4H,1-2,10H2;1H |
| InChI Key | YJIYYMLVZMYMSL-UHFFFAOYSA-N |
| MDL Number | MFCD11505406 |
| Molecular Formula | C8H9Cl2NO2 |
| Molecular Weight | 222.0686 |
| SMILES | C1=C(N)C(Cl)=CC2OCCOC1=2.Cl |
| Synonyms | 7-chloro-2,3-dihydro-1,4-benzodioxin-6-amine hydrochloride,
855222-36-5,
(7-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl)amine hydrochloride,
7-Chloro-2,3-dihydro-benzo[1,4]dioxin-6-ylamine hydrochloride,
7-Chloro-2,3-dihydrobenzo[b][1,4]dioxin-6-amine hydrochloride,
AC1Q3CWQ,
CTK7D6072,
MFCD11505406,
AKOS015846009,
NE15154,
TR-056088,
EN300-39294,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.065g/mol |
| Monoisotopic Mass | 221.001g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number