2-Chloro-2-(hydroxyimino)acetic Acid Methyl Ester - CAS 30673-27-9
Catalog: |
BB070099 |
Product Name: |
2-Chloro-2-(hydroxyimino)acetic Acid Methyl Ester |
CAS: |
30673-27-9 |
Synonyms: |
Methyl Chlorooximidoacetate; Methyl Chlorooximinoacetate; Chloro-glyoxylic Acid Methyl Ester 2-Oxime |
IUPAC Name: | methyl (2Z)-2-chloro-2-hydroxyiminoacetate |
Description: | Useful in the preparation of industrial microbicides. |
Molecular Weight: | 137.52 |
Molecular Formula: | C3H4ClNO3 |
Canonical SMILES: | COC(=O)C(=NO)Cl |
InChI: | InChI=1S/C3H4ClNO3/c1-8-3(6)2(4)5-7/h7H,1H3/b5-2- |
InChI Key: | QGSZBXNCEKAJIH-DJWKRKHSSA-N |
Solubility: | Chloroform |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 136.9879707 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.9879707 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 58.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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