2,2-Bis(4-chlorophenyl)-1,1-dichloroethylene - CAS 72-55-9
Catalog: |
BB034651 |
Product Name: |
2,2-Bis(4-chlorophenyl)-1,1-dichloroethylene |
CAS: |
72-55-9 |
Synonyms: |
1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene |
IUPAC Name: | 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene |
Description: | p,p'-DDE is a metabolite and degradation product of DDT, an organochlorine pesticide. It induces morphological changes and activation of the PKCα-p38-C/EBPβ pathway in human promyelocytic HL-60 cells. |
Molecular Weight: | 318.03 |
Molecular Formula: | C14H8Cl4 |
Canonical SMILES: | C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl |
InChI: | InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H |
InChI Key: | UCNVFOCBFJOQAL-UHFFFAOYSA-N |
Boiling Point: | 601.7 °F at 760 mmHg |
Melting Point: | 89-90 °C |
Purity: | ≥ 98 % |
Solubility: | less than 0.1 mg/mL at 72 °F |
Appearance: | Solid powder |
Decomposition: | When heated to decomposition it emits very toxic fumes of /chlorides |
LogP: | 6.18790 |
Vapor Pressure: | 0.000006 [mmHg] |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P311, P312, P321, P322, P330, P332+P313, P361, P362, P363, P391, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112979043-A | Purification and recovery device of synergistic eluent for restoring organochlorine pesticide contaminated soil | 20210305 |
AU-2020103867-A4 | A constructed wetland sewage treatment simulation device in circulating inflow mode | 20201203 |
WO-2021195626-A1 | The use of molecularly imprinted polymers for the rapid detection of emerging viral outbreaks | 20200327 |
CN-111189942-A | Method for determining residue of hexachloro cyclohexane soprocide and dichlorodiphenyl trichloroethane in industrial marihuana leaves | 20200210 |
CN-110161144-A | The detection method of organochlorine class and pyrethroid pesticide remained amount in a kind of food | 20190613 |
PMID | Publication Date | Title | Journal |
34000504 | 20211101 | A mixture of 15 phthalates and pesticides below individual chemical no observed adverse effect levels (NOAELs) produces reproductive tract malformations in the male rat | Environment international |
34383603 | 20210801 | Multi- and Transgenerational Outcomes of an Exposure to a Mixture of Endocrine-Disrupting Chemicals (EDCs) on Puberty and Maternal Behavior in the Female Rat | Environmental health perspectives |
33049310 | 20210401 | Evaluation of a multiplexed, multispecies nuclear receptor assay for chemical hazard assessment | Toxicology in vitro : an international journal published in association with BIBRA |
33571556 | 20210330 | Mixtures of persistent organic pollutants increase ovarian granulosa tumor cell line migration and spheroid invasion by upregulating MMP2 expression and activity via IGF1R | Toxicology |
32721735 | 20201110 | Autophagy-related neurotoxicity is mediated via AHR and CAR in mouse neurons exposed to DDE | The Science of the total environment |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 317.935061 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.938011 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7 |
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