| CAS Number | 31697-39-9 |
| Catalog Number | AG00C8LM(AGN-PC-0WCZDF) |
| Chemical Name | (S)-2-Amino-3-(dimethylamino)propanoic acid dihydrochloride |
| IUPAC Name | (2S)-2-amino-3-(dimethylamino)propanoic acid;dihydrochloride |
| InChI | InChI=1S/C5H12N2O2.2ClH/c1-7(2)3-4(6)5(8)9;;/h4H,3,6H2,1-2H3,(H,8,9);2*1H/t4-;;/m0../s1 |
| InChI Key | OZWNGZATZQMSHU-FHNDMYTFSA-N |
| MDL Number | MFCD00216903 |
| Molecular Formula | C5H14Cl2N2O2 |
| Molecular Weight | 205.0829 |
| SMILES | Cl.Cl.CN(C[C@@H](C(O)=O)N)C |
| Synonyms | 31697-39-9,
(S)-2-AMINO-3-DIMETHYLAMINOPROPIONIC ACID 2HCL,
(S)-2-Amino-3-(dimethylamino)propanoic acid dihydrochloride,
(S)-2-AMINO-3-DIMETHYLAMINO-PROPIONIC ACID DIHYDROCHLORIDE,
(S)-2-Amino-3-dimethylaminopropionic acid dihydrochloride,
DTXSID20705328,
MFCD11501149,
AS-35770,
AB0073757,
AX8048638,
X-1793,
3-(Dimethylamino)-L-alanine--hydrogen chloride (1/2),
(S)-2-Amino-3-(dimethylamino)propanoicaciddihydrochloridemonohydrate,
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| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.079g/mol |
| Monoisotopic Mass | 204.043g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.6A^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