3,5-Dichloro-4-methoxybenzoyl Chloride - CAS 29568-76-1
Catalog: |
BB020240 |
Product Name: |
3,5-Dichloro-4-methoxybenzoyl Chloride |
CAS: |
29568-76-1 |
Synonyms: |
3,5-dichloro-4-methoxybenzoyl chloride; 3,5-dichloro-4-methoxybenzoyl chloride |
IUPAC Name: | 3,5-dichloro-4-methoxybenzoyl chloride |
Description: | 3,5-Dichloro-4-methoxybenzoyl Chloride (CAS# 29568-76-1) is a useful research chemical. |
Molecular Weight: | 239.48 |
Molecular Formula: | C8H5Cl3O2 |
Canonical SMILES: | COC1=C(C=C(C=C1Cl)C(=O)Cl)Cl |
InChI: | InChI=1S/C8H5Cl3O2/c1-13-7-5(9)2-4(8(11)12)3-6(7)10/h2-3H,1H3 |
InChI Key: | XWIGDNQZKUVSQD-UHFFFAOYSA-N |
Boiling Point: | 313.5 °C at 760 mmHg |
Density: | 1.462 g/cm3 |
MDL: | MFCD02063082 |
LogP: | 3.38100 |
Publication Number | Title | Priority Date |
US-2014336187-A1 | Methods for treating leishmaniasis | 20111118 |
WO-2013074930-A1 | Methods for treating leishmaniasis | 20111118 |
CN-103328462-A | Indeno-fused ring compounds | 20110831 |
US-2015073177-A1 | Method for inhibiting trypanosoma cruzi | 20110727 |
US-9422231-B2 | Method for inhibiting Trypanosoma cruzi | 20110727 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.935512 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.935512 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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