2'-Chloro-4'-(4-chlorophenoxy)acetophenone - CAS 119851-28-4
Catalog: |
BB004672 |
Product Name: |
2'-Chloro-4'-(4-chlorophenoxy)acetophenone |
CAS: |
119851-28-4 |
Synonyms: |
1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone; 1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone |
IUPAC Name: | 1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone |
Description: | This compound serves as a reactant in the prepn. of a fungicide that targets plant pathogenic fungi. |
Molecular Weight: | 281.13 |
Molecular Formula: | C14H10Cl2O2 |
Canonical SMILES: | CC(=O)C1=C(C=C(C=C1)OC2=CC=C(C=C2)Cl)Cl |
InChI: | InChI=1S/C14H10Cl2O2/c1-9(17)13-7-6-12(8-14(13)16)18-11-4-2-10(15)3-5-11/h2-8H,1H3 |
InChI Key: | BDTJIVUVQRVLLJ-UHFFFAOYSA-N |
Boiling Point: | 369.2 °C at 760 mmHg |
Density: | 1.304 g/cm3 |
Storage: | Keep in dark place, Sealed in dry, Room Temperature |
MDL: | MFCD00140226 |
LogP: | 4.98830 |
GHS Hazard Statement: | H317 (17.71%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113336715-A | Preparation method of triazole compound containing dioxolane and intermediate thereof | 20210804 |
CN-113247996-A | Method for treating aluminum trichloride wastewater | 20210208 |
JP-2020186178-A | Agricultural and horticultural chemicals, plant disease control methods, and plant disease control products | 20190510 |
WO-2020213739-A1 | Bactericidal agent for agricultural or horticultural use, plant disease control method, and product for plant disease control use | 20190419 |
JP-6942284-B2 | Agricultural and horticultural fungicides, plant disease control methods and plant disease control products | 20190419 |
Complexity: | 288 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 280.0057849 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 280.0057849 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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