3,4-Dimethoxy-2-methylbenzoic Acid - CAS 5722-94-1
Catalog: |
BB029613 |
Product Name: |
3,4-Dimethoxy-2-methylbenzoic Acid |
CAS: |
5722-94-1 |
Synonyms: |
3,4-dimethoxy-2-methylbenzoic acid; 3,4-dimethoxy-2-methylbenzoic acid |
IUPAC Name: | 3,4-dimethoxy-2-methylbenzoic acid |
Description: | 3,4-Dimethoxy-2-methylbenzoic Acid (CAS# 5722-94-1) is a useful synthetic intermediate. It is used to synthesize 5,5'-didesisopropyl-5,5'-dialkylapogossypol derivatives. |
Molecular Weight: | 196.20 |
Molecular Formula: | C10H12O4 |
Canonical SMILES: | CC1=C(C=CC(=C1OC)OC)C(=O)O |
InChI: | InChI=1S/C10H12O4/c1-6-7(10(11)12)4-5-8(13-2)9(6)14-3/h4-5H,1-3H3,(H,11,12) |
InChI Key: | OUEJXYZKZCQELU-UHFFFAOYSA-N |
MDL: | MFCD09701444 |
LogP: | 1.71040 |
Publication Number | Title | Priority Date |
AU-2021203261-B1 | Novel dioxoloisoquinolinone derivatives and use thereof | 20200813 |
KR-20200101219-A | Novel heterotricyclic derivatives and use thereof | 20190219 |
TW-202045512-A | Novel heterotricyclic derivatives and use thereof | 20190219 |
WO-2020171606-A1 | Novel heterotricyclic derivative compound and use of same | 20190219 |
CN-113423710-A | Novel heterocyclic tricyclic derivative compound and use thereof | 20190219 |
Complexity: | 204 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.07355886 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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