| CAS Number | 126147-80-6 |
| Catalog Number | AG009F2P(AGN-PC-0O0RQJ) |
| Chemical Name | (2S)-1,1-diethoxypropan-2-amine |
| IUPAC Name | (2S)-1,1-diethoxypropan-2-amine |
| InChI | InChI=1S/C7H17NO2/c1-4-9-7(6(3)8)10-5-2/h6-7H,4-5,8H2,1-3H3/t6-/m0/s1 |
| InChI Key | MLTOHCRTGWUMIR-LURJTMIESA-N |
| MDL Number | MFCD19203953 |
| Molecular Formula | C7H17NO2 |
| Molecular Weight | 147.2154 |
| SMILES | CCOC([C@@H](N)C)OCC |
| Synonyms | (S)-1,1-Diethoxy-2-propanamine,
126147-80-6,
SCHEMBL1285795,
MLTOHCRTGWUMIR-LURJTMIESA-N,
ZINC20216980,
AKOS006341385,
AJ-76342,
(S)-1,1-diethoxypropan-2-amine,
|
| Complexity | 72 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.218g/mol |
| Monoisotopic Mass | 147.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number