| CAS Number | 40916-65-2 |
| Catalog Number | AG01B8U1(AGN-PC-0OA8HO) |
| Chemical Name | (2S)-2-(dimethylamino)propan-1-ol |
| IUPAC Name | (2S)-2-(dimethylamino)propan-1-ol |
| InChI | InChI=1S/C5H13NO/c1-5(4-7)6(2)3/h5,7H,4H2,1-3H3/t5-/m0/s1 |
| InChI Key | PBKGYWLWIJLDGZ-YFKPBYRVSA-N |
| MDL Number | MFCD10569653 |
| Molecular Formula | C5H13NO |
| Molecular Weight | 103.1628 |
| SMILES | C[C@H](N(C)C)CO |
| Synonyms | (S)-2-(Dimethylamino)-1-propanol,
(2S)-2-(Dimethylamino)propan-1-ol,
40916-65-2,
Dimethyl-alaninol,
SCHEMBL3807883,
CTK1C9234,
PBKGYWLWIJLDGZ-YFKPBYRVSA-N,
ZINC1759085,
AKOS026732181,
1-Propanol, 2-(dimethylamino)-, (S)-,
(2S)-2-(DIMETHYLAMINO)-1-PROPANOL,
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| Complexity | 45.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 103.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 103.165g/mol |
| Monoisotopic Mass | 103.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
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Certificate of Analysis
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