2-Methoxy-3-methylphenol - CAS 18102-31-3
Catalog: |
BB059226 |
Product Name: |
2-Methoxy-3-methylphenol |
CAS: |
18102-31-3 |
Synonyms: |
2-Methoxy-3-methylphenol; 3-Methylguaiacol |
IUPAC Name: | 2-methoxy-3-methylphenol |
Description: | 2-Methoxy-3-methylphenol is a found in the thermal degredation of lignans. |
Molecular Weight: | 138.16 |
Molecular Formula: | C8H10O2 |
Canonical SMILES: | CC1=C(C(=CC=C1)O)OC |
InChI: | InChI=1S/C8H10O2/c1-6-4-3-5-7(9)8(6)10-2/h3-5,9H,1-2H3 |
InChI Key: | SHESIBIEPSTHMZ-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), DMSO (Slightly) |
Appearance: | Dark Yellow Oil |
Storage: | 4°C, Inert atmosphere |
References: | Gomez, J. et al. Braz. Arch. Biol. Tech., 64, e21190730 (2021). |
Complexity: | 103 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.068079557 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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