Methyl 2,4-dichlorobenzoate - CAS 35112-28-8
Catalog: |
BB022475 |
Product Name: |
Methyl 2,4-dichlorobenzoate |
CAS: |
35112-28-8 |
Synonyms: |
methyl 2,4-dichlorobenzoate |
IUPAC Name: | methyl 2,4-dichlorobenzoate |
Description: | Methyl 2,4-dichlorobenzoate (CAS# 35112-28-8) is a useful research chemical. |
Molecular Weight: | 205.04 |
Molecular Formula: | C8H6Cl2O2 |
Canonical SMILES: | COC(=O)C1=C(C=C(C=C1)Cl)Cl |
InChI: | InChI=1S/C8H6Cl2O2/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4H,1H3 |
InChI Key: | VCRWILYAWSRHBN-UHFFFAOYSA-N |
Boiling Point: | 255.9 °C at 760 mmHg |
Density: | 1.355 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD00085117 |
LogP: | 2.78000 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110694652-A | Method for generating ester compound by catalytic oxidation of ether compound with visible light excited silver iodide and bismuth vanadate composite material | 20191026 |
WO-2020117877-A1 | Compounds, compositions and methods of use | 20181204 |
AU-2017388277-A1 | Agricultural chemicals | 20161229 |
BR-112019013628-A2 | agricultural chemicals | 20161229 |
US-2019322627-A1 | Agricultural chemicals | 20161229 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.9744848 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.9744848 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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