DTXSID701134102
4-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]butanoic acid
| Molecular Formula | C12H18N2O4 |
|---|---|
| Molecular Weight | 254.28 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 103.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 254.12666 |
| Heavy Atoms | 18 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 136027-67-3 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CNCCCC(=O)O)CO |
| InChIKey | WNRXJRWXXKRQKA-UHFFFAOYSA-N |
📖 Product Overview
DTXSID701134102 (CAS: 136027-67-3) is a chemical compound with molecular formula C12H18N2O4 and molecular weight 254.28 g/mol. Its IUPAC systematic name is 4-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]butanoic acid.
WNRXJRWXXKRQKA-UHFFFAOYSA-N.
SMILES: CC1=NC=C(C(=C1O)CNCCCC(=O)O)CO.
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