| CAS Number | 65103-50-6 |
| Catalog Number | AG00IBGD(AGN-PC-0TFDMD) |
| Chemical Name | b-Alanine, N-methyl-, methyl ester, hydrochloride |
| IUPAC Name | methyl 3-(methylamino)propanoate;hydrochloride |
| InChI | InChI=1S/C5H11NO2.ClH/c1-6-4-3-5(7)8-2;/h6H,3-4H2,1-2H3;1H |
| InChI Key | GYJOTTXQHSJQOF-UHFFFAOYSA-N |
| MDL Number | MFCD08456671 |
| Molecular Formula | C5H12ClNO2 |
| Molecular Weight | 153.6073 |
| SMILES | Cl.CNCCC(=O)OC |
| Synonyms | 65103-50-6,
methyl 3-(methylamino)propanoate hydrochloride,
Methyl 3-(methylamino)propanoate HCl,
3-Methylamino-propionic acid methyl ester hydrochloride,
SCHEMBL380895,
TMA009,
GYJOTTXQHSJQOF-UHFFFAOYSA-N,
MFCD08456671,
DA-04632,
methyl N-methyl-beta-alaninate hydrochloride,
FT-0702642,
X3419,
b-Alanine, N-methyl-, methyl ester, hydrochloride,
C5H11NO2.ClH,
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| Complexity | 72.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.606g/mol |
| Monoisotopic Mass | 153.056g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^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