| CAS Number | 860585-53-1 |
| Catalog Number | AG01A2Y0(AGN-PC-0WNL9E) |
| Chemical Name | 6-Chloro-2h-1,3-benzodioxol-5-amine hydrochloride |
| IUPAC Name | 6-chloro-1,3-benzodioxol-5-amine;hydrochloride |
| InChI | InChI=1S/C7H6ClNO2.ClH/c8-4-1-6-7(2-5(4)9)11-3-10-6;/h1-2H,3,9H2;1H |
| InChI Key | VFRWGYBNVDWZBP-UHFFFAOYSA-N |
| MDL Number | MFCD11506502 |
| Molecular Formula | C7H7Cl2NO2 |
| Molecular Weight | 208.0420 |
| SMILES | Cl.NC1=C(Cl)C=C2C(OCO2)=C1 |
| Synonyms | 860585-53-1,
6-CHLORO-BENZO[1,3]DIOXOL-5-YLAMINE HYDROCHLORIDE,
6-chloro-2H-1,3-benzodioxol-5-amine hydrochloride,
6-Chlorobenzo[d][1,3]dioxol-5-amine hydrochloride,
CTK6G7301,
AKOS015846010,
NE17458,
TR-055923,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.038g/mol |
| Monoisotopic Mass | 206.985g/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