Methyl 2-Hydroxy-4-methylbenzoate - CAS 4670-56-8
Catalog: |
BB026169 |
Product Name: |
Methyl 2-Hydroxy-4-methylbenzoate |
CAS: |
4670-56-8 |
Synonyms: |
2-hydroxy-4-methylbenzoic acid methyl ester; methyl 2-hydroxy-4-methylbenzoate |
IUPAC Name: | methyl 2-hydroxy-4-methylbenzoate |
Description: | Methyl 2-Hydroxy-4-methylbenzoate (CAS# 4670-56-8) is a useful research chemical. |
Molecular Weight: | 166.17 |
Molecular Formula: | C9H10O3 |
Canonical SMILES: | CC1=CC(=C(C=C1)C(=O)OC)O |
InChI: | InChI=1S/C9H10O3/c1-6-3-4-7(8(10)5-6)9(11)12-2/h3-5,10H,1-2H3 |
InChI Key: | UITFCFWKYAOJEJ-UHFFFAOYSA-N |
Boiling Point: | 241.2 °C at 760 mmHg |
Flash Point: | 28 °C |
Density: | 1.169 g/cm3 |
MDL: | MFCD00020130 |
LogP: | 1.48720 |
Refractive Index: | 1.542 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113480534-A | Benzimidazole or azabenzimidazole-6-carboxylic acid compounds and application thereof | 20210723 |
CN-112979571-A | AKR1C3 selective inhibitor, preparation method and application thereof | 20210224 |
JP-2021130079-A | Liquid fixed quantity discharge device | 20200218 |
WO-2021158481-A1 | Substituted 1,1'-biphenyl compounds and methods using same | 20200203 |
CN-111719312-A | Soft water-absorbing fabric and application thereof | 20190322 |
PMID | Publication Date | Title | Journal |
18022305 | 20070101 | Fragrance material review on methyl 4-methylsalicylate | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
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: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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