| CAS Number | 937685-33-1 |
| Catalog Number | AG01BB5S |
| Chemical Name | 2-[(1-Methyl-1H-imidazol-2-yl)methoxy]acetic acid |
| IUPAC Name | 2-[(1-methylimidazol-2-yl)methoxy]acetic acid |
| InChI | InChI=1S/C7H10N2O3/c1-9-3-2-8-6(9)4-12-5-7(10)11/h2-3H,4-5H2,1H3,(H,10,11) |
| InChI Key | XMFBUONCRPWWSU-UHFFFAOYSA-N |
| MDL Number | MFCD09036066 |
| Molecular Formula | C7H10N2O3 |
| Molecular Weight | 170.1659 |
| SMILES | CN1C(COCC(O)=O)=NC=C1 |
| Synonyms | 2-[(1-methyl-1H-imidazol-2-yl)methoxy]acetic acid,
937685-33-1,
ZINC88189307,
AKOS004117896,
Z2510258150,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.168g/mol |
| Monoisotopic Mass | 170.069g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
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Certificate of Analysis
Lot Number