| CAS Number | 41456-54-6 |
| Catalog Number | AG01ACP1(AGN-PC-02VV0A) |
| Chemical Name | 5-Chloro-N,2-dimethylaniline |
| IUPAC Name | 5-chloro-N,2-dimethylaniline |
| InChI | InChI=1S/C8H10ClN/c1-6-3-4-7(9)5-8(6)10-2/h3-5,10H,1-2H3 |
| InChI Key | MMOJEOOKQSPVMJ-UHFFFAOYSA-N |
| MDL Number | MFCD03030402 |
| Molecular Formula | C8H10ClN |
| Molecular Weight | 155.6247 |
| SMILES | CC1=CC=C(Cl)C=C1NC |
| Synonyms | 5-chloro-N,2-dimethylaniline,
41456-54-6,
SCHEMBL9232234,
ZINC20033089,
AKOS000247851,
MCULE-2511266790,
AJ-75920,
Z1403323086,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.625g/mol |
| Monoisotopic Mass | 155.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number