(2-Methoxy-5-methylphenyl)acetic acid - CAS 58506-24-4
Catalog: |
BB076131 |
Product Name: |
(2-Methoxy-5-methylphenyl)acetic acid |
CAS: |
58506-24-4 |
Synonyms: |
2-Methoxy-5-methylphenylacetic acid; (2-methoxy-5-methylphenyl)acetic acid; 2-(2-methoxy-5-methylphenyl)acetic acid; (2-Methoxy-5-methyl-phenyl)-acetic acid; 2-Methoxy-5-methylphenylaceticacid; 2-methoxy-5-methylbenzeneacetic acid |
IUPAC Name: | 2-(2-methoxy-5-methylphenyl)acetic acid |
Description: | (2-Methoxy-5-methylphenyl)acetic acid |
Molecular Weight: | 180.2 |
Molecular Formula: | C10H12O3 |
Canonical SMILES: | CC1=CC(=C(C=C1)OC)CC(=O)O |
InChI: | InChI=1S/C10H12O3/c1-7-3-4-9(13-2)8(5-7)6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12) |
InChI Key: | GHVGGBAEPWMNGB-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.078644241 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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