| CAS Number | 1193388-52-1 |
| Catalog Number | AG019W7P |
| Chemical Name | N,2,3-trimethylaniline hydrochloride |
| IUPAC Name | N,2,3-trimethylaniline;hydrochloride |
| InChI | InChI=1S/C9H13N.ClH/c1-7-5-4-6-9(10-3)8(7)2;/h4-6,10H,1-3H3;1H |
| InChI Key | HLCRYDGEFJBQNB-UHFFFAOYSA-N |
| MDL Number | MFCD12912898 |
| Molecular Formula | C9H14ClN |
| Molecular Weight | 171.6672 |
| SMILES | Cl.CNC1=C(C)C(C)=CC=C1 |
| Synonyms | N,2,3-trimethylaniline hydrochloride,
1193388-52-1,
AC1Q3BPM,
SCHEMBL2871283,
CTK6I4906,
MCULE-1440523768,
NE27224,
EN300-50968,
|
| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.668g/mol |
| Monoisotopic Mass | 171.081g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number