| CAS Number | 91944-64-8 |
| Catalog Number | AG00IGYO(AGN-PC-0VXFUF) |
| Chemical Name | 4-Pyridinamine, N,N-dimethyl-, mono(4-methylbenzenesulfonate) |
| IUPAC Name | N,N-dimethylpyridin-4-amine;4-methylbenzenesulfonic acid |
| InChI | InChI=1S/C7H10N2.C7H8O3S/c1-9(2)7-3-5-8-6-4-7;1-6-2-4-7(5-3-6)11(8,9)10/h3-6H,1-2H3;2-5H,1H3,(H,8,9,10) |
| InChI Key | OAOSXODRWGDDCV-UHFFFAOYSA-N |
| MDL Number | MFCD25372259 |
| Molecular Formula | C14H18N2O3S |
| Molecular Weight | 294.3693 |
| SMILES | CN(C)C1=CC=NC=C1.O=S(C2=CC=C(C)C=C2)(O)=O |
| Synonyms | N,N-Dimethylpyridin-4-amine 4-methylbenzenesulfonate,
91944-64-8,
AK311262,
4-Pyridinamine, N,N-dimethyl-, mono(4-methylbenzenesulfonate),
KS-00000QRM,
MFCD25372259,
AKOS027250591,
CS-W022910,
DS-11703,
4-dimethylaminopyridine-p-toluene sulfonate,
FT-0699454,
CID11781380,
IUPAC: N,N-dimethylpyridin-4-amine; 4-methylbenzenesulfonic Acid,
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| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 294.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.369g/mol |
| Monoisotopic Mass | 294.104g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 78.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number