| CAS Number | 1073159-75-7 |
| Catalog Number | AG0095Q1(AGN-PC-0WAMCY) |
| Chemical Name | N-(3-AMinoMethyl-pyridin-2-yl)-N-Methyl-MethanesulfonaMide acetate |
| IUPAC Name | acetic acid;N-[3-(aminomethyl)pyridin-2-yl]-N-methylmethanesulfonamide |
| InChI | InChI=1S/C8H13N3O2S.C2H4O2/c1-11(14(2,12)13)8-7(6-9)4-3-5-10-8;1-2(3)4/h3-5H,6,9H2,1-2H3;1H3,(H,3,4) |
| InChI Key | UHSRGGRAWZGCDW-UHFFFAOYSA-N |
| MDL Number | MFCD29044904 |
| Molecular Formula | C10H17N3O4S |
| Molecular Weight | 275.3247 |
| SMILES | CS(=O)(N(C1=NC=CC=C1CN)C)=O.CC(O)=O |
| Synonyms | 1073159-75-7,
N-(3-(Aminomethyl)pyridin-2-yl)-N-methylmethanesulfonamide acetate,
AK174409,
N-(3-Aminomethyl-pyridin-2-yl)-N-methyl-methanesulfonamide acetate,
SCHEMBL1627284,
UHSRGGRAWZGCDW-UHFFFAOYSA-N,
KS-00000T4K,
MFCD29044904,
AKOS025404720,
DS-8724,
SB10511,
acetic acid;N-[3-(aminomethyl)pyridin-2-yl]-N-methylmethanesulfonamide,
N-[3-(AMINOMETHYL)PYRIDIN-2-YL]-N-METHYLMETHANESULFONAMIDE; ACETIC ACID,
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| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.323g/mol |
| Monoisotopic Mass | 275.094g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 122A^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