Methyl 5-Bromo-2-chloro-3-methoxybenzoate - CAS 697762-67-7
Catalog: |
BB033968 |
Product Name: |
Methyl 5-Bromo-2-chloro-3-methoxybenzoate |
CAS: |
697762-67-7 |
Synonyms: |
5-bromo-2-chloro-3-methoxybenzoic acid methyl ester; methyl 5-bromo-2-chloro-3-methoxybenzoate |
IUPAC Name: | methyl 5-bromo-2-chloro-3-methoxybenzoate |
Description: | Methyl 5-Bromo-2-chloro-3-methoxybenzoate (CAS# 697762-67-7 ) is a useful research chemical. |
Molecular Weight: | 279.52 |
Molecular Formula: | C9H8BrClO3 |
Canonical SMILES: | COC1=C(C(=CC(=C1)Br)C(=O)OC)Cl |
InChI: | InChI=1S/C9H8BrClO3/c1-13-7-4-5(10)3-6(8(7)11)9(12)14-2/h3-4H,1-2H3 |
InChI Key: | IEMDCTKBMXAVHF-UHFFFAOYSA-N |
LogP: | 2.89770 |
Publication Number | Title | Priority Date |
WO-2020117877-A1 | Compounds, compositions and methods of use | 20181204 |
AU-2017285813-A1 | Method for producing diphenylmethane derivative | 20160617 |
AU-2017285813-B2 | Method for producing diphenylmethane derivative | 20160617 |
CA-3026756-A1 | Method for producing diphenylmethane derivative | 20160617 |
EP-3473621-A1 | Method for producing diphenylmethane derivative | 20160617 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.93453 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.93453 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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