| CAS Number | 1240528-10-2 |
| Catalog Number | AG01A9LD |
| Chemical Name | 2-amino-2-(3,5-dichlorophenyl)acetonitrile hydrochloride |
| IUPAC Name | 2-amino-2-(3,5-dichlorophenyl)acetonitrile;hydrochloride |
| InChI | InChI=1S/C8H6Cl2N2.ClH/c9-6-1-5(8(12)4-11)2-7(10)3-6;/h1-3,8H,12H2;1H |
| InChI Key | IOIPVALHMXRHBW-UHFFFAOYSA-N |
| MDL Number | MFCD16622134 |
| Molecular Formula | C8H7Cl3N2 |
| Molecular Weight | 237.5136 |
| SMILES | Cl.NC(C1=CC(Cl)=CC(Cl)=C1)C#N |
| Synonyms | 2-amino-2-(3,5-dichlorophenyl)acetonitrile hydrochloride,
1240528-10-2,
EN300-65407,
AC1Q3CT4,
MCULE-4872237385,
NE55514,
Z1262398370,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.967g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.508g/mol |
| Monoisotopic Mass | 235.967g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number