| CAS Number | 124335-43-9 |
| Catalog Number | AG019U47(AGN-PC-0WO5MB) |
| Chemical Name | 3-[(2-hydroxyethyl)(methyl)amino]propanoic acid |
| IUPAC Name | 3-[2-hydroxyethyl(methyl)amino]propanoic acid |
| InChI | InChI=1S/C6H13NO3/c1-7(4-5-8)3-2-6(9)10/h8H,2-5H2,1H3,(H,9,10) |
| InChI Key | QEBLLSSGRQCVJI-UHFFFAOYSA-N |
| MDL Number | MFCD09716816 |
| Molecular Formula | C6H13NO3 |
| Molecular Weight | 147.1723 |
| SMILES | O=C(O)CCN(CCO)C |
| Synonyms | 3-[(2-hydroxyethyl)(methyl)amino]propanoic acid,
124335-43-9,
SCHEMBL3952397,
ZINC11958936,
AKOS008963149,
MCULE-1755715725,
NE14294,
Z53116523,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.174g/mol |
| Monoisotopic Mass | 147.09g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 60.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number