Methyl 2-Hydroxy-6-methylbenzoate - CAS 33528-09-5
Catalog: |
BB076044 |
Product Name: |
Methyl 2-Hydroxy-6-methylbenzoate |
CAS: |
33528-09-5 |
Synonyms: |
2-Hydroxy-6-methylbenzoic Acid Methyl Ester;Methyl 6-Methylsalicylate;Methyl 2,6-Cresotic Acid |
IUPAC Name: | methyl 2-hydroxy-6-methylbenzoate |
Description: | Methyl 2-hydroxy-6-methylbenzoate (cas# 33528-09-5) is used in the method for controlling ant colonies. |
Molecular Weight: | 166.17 |
Molecular Formula: | C9H10O3 |
Canonical SMILES: | CC1=C(C(=CC=C1)O)C(=O)OC |
InChI: | InChI=1S/C9H10O3/c1-6-4-3-5-7(10)8(6)9(11)12-2/h3-5,10H,1-2H3 |
InChI Key: | GPNCYIZKJTXKRO-UHFFFAOYSA-N |
References: | Lagrain, B., et al. PCT Int. Appl. 73 pp. (2015). |
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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.062994177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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