| CAS Number | 15190-07-5 |
| Catalog Number | AG01AQ16(AGN-PC-0Q689G) |
| Chemical Name | 2-(2-Chlorophenyl)-2-(dimethylamino)acetonitrile |
| IUPAC Name | 2-(2-chlorophenyl)-2-(dimethylamino)acetonitrile |
| InChI | InChI=1S/C10H11ClN2/c1-13(2)10(7-12)8-5-3-4-6-9(8)11/h3-6,10H,1-2H3 |
| InChI Key | DAOSLFYYPSHQRU-UHFFFAOYSA-N |
| MDL Number | MFCD00835199 |
| Molecular Formula | C10H11ClN2 |
| Molecular Weight | 194.6607 |
| SMILES | CN(C(C1=C(Cl)C=CC=C1)C#N)C |
| Synonyms | (2-chlorophenyl)(dimethylamino)acetonitrile,
15190-07-5,
2-(2-chlorophenyl)-2-(dimethylamino)acetonitrile,
F2189-0189,
AC1N5TS6,
AKOS009985615,
FCH5429320,
MCULE-3061597534,
BBV-27277490,
EN300-235997,
CID4203534,
2-(2-chlorophenyl)-2-dimethylamino-acetonitrile,
N/A,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.662g/mol |
| Monoisotopic Mass | 194.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 27A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number