2-(3-Methoxyphenyl)-6-methylbenzoic acid - CAS 1261948-32-6
Catalog: |
BB059380 |
Product Name: |
2-(3-Methoxyphenyl)-6-methylbenzoic acid |
CAS: |
1261948-32-6 |
Synonyms: |
2-(3-METHOXYPHENYL)-6-METHYLBENZOIC ACID; 2-(3-METHOXYPHENYL)-6-METHYLBENZOICACID; 3'-Methoxy-3-methyl[1,1'-biphenyl]-2-carboxylic acid |
IUPAC Name: | 2-(3-methoxyphenyl)-6-methylbenzoic acid |
Description: | 2-(3-Methoxyphenyl)-6-methylbenzoic acid |
Molecular Weight: | 242.27 |
Molecular Formula: | C15H14O3 |
Canonical SMILES: | CC1=C(C(=CC=C1)C2=CC(=CC=C2)OC)C(=O)O |
InChI: | InChI=1S/C15H14O3/c1-10-5-3-8-13(14(10)15(16)17)11-6-4-7-12(9-11)18-2/h3-9H,1-2H3,(H,16,17) |
InChI Key: | YDBJUQJDEZXKRP-UHFFFAOYSA-N |
Complexity: | 290 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.094294304 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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