| CAS Number | 30673-27-9 |
| Catalog Number | AG00C328(AGN-PC-0MUZS7) |
| Chemical Name | Methyl 2-chloro-2-(hydroxyimino)acetate |
| IUPAC Name | methyl (2Z)-2-chloro-2-hydroxyiminoacetate |
| InChI | InChI=1S/C3H4ClNO3/c1-8-3(6)2(4)5-7/h7H,1H3/b5-2- |
| InChI Key | QGSZBXNCEKAJIH-DJWKRKHSSA-N |
| MDL Number | MFCD17215004 |
| Molecular Formula | C3H4ClNO3 |
| Molecular Weight | 137.5218 |
| SMILES | COC(C(Cl)=NO)=O |
| Synonyms | 30673-27-9,
2-Chloro-2-(hydroxyimino)acetic Acid Methyl Ester,
methyl (2Z)-2-chloro-2-hydroxyiminoacetate,
SCHEMBL15395937,
AKOS024462251,
methyl (2Z)-chloro(hydroxyimino)ethanoate,
CID9877384,
methyl 2-chloro-2-(hydroxyimino)acetate,
Methyl (2Z)-2-chloro-2-hydroxyimino-acetate,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 136.988g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.519g/mol |
| Monoisotopic Mass | 136.988g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number