| CAS Number | 158400-44-3 |
| Catalog Number | AG00AQKC(AGN-PC-025NH8) |
| Chemical Name | 4-Methoxy-3,5-dimethylaniline HCl |
| IUPAC Name | 4-methoxy-3,5-dimethylaniline;hydrochloride |
| InChI | InChI=1S/C9H13NO.ClH/c1-6-4-8(10)5-7(2)9(6)11-3;/h4-5H,10H2,1-3H3;1H |
| InChI Key | ZIFOMDOKIQPLAL-UHFFFAOYSA-N |
| MDL Number | MFCD22586681 |
| Molecular Formula | C9H14ClNO |
| Molecular Weight | 187.6666 |
| SMILES | COc1c(C)cc(cc1C)N.Cl |
| Synonyms | 4-Methoxy-3,5-dimethylaniline HCl,
158400-44-3,
4-Methoxy-3,5-dimethylaniline hydrochloride,
SCHEMBL8931696,
ZIFOMDOKIQPLAL-UHFFFAOYSA-N,
KM3584,
4-AMINO-2,6-DIMETHYLANISOLE HCL,
V3564,
4-methoxy-3,5-dimethylbenzenamine hydrochloride,
C9H14ClNO,
|
| Complexity | 115 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.667g/mol |
| Monoisotopic Mass | 187.076g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number