4,4'-DDMU - CAS 1022-22-6
Catalog: |
BB054112 |
Product Name: |
4,4'-DDMU |
CAS: |
1022-22-6 |
Synonyms: |
p,p'-DDD olefin; 1,1-Bis(p-chlorophenyl)-2-chloroethene; p,p'-TDE olefin; 2,2-Bis(p-Chlorophenyl)-1-chloroethylene |
IUPAC Name: | 1-chloro-4-[2-chloro-1-(4-chlorophenyl)ethenyl]benzene |
Molecular Weight: | 283.58 |
Molecular Formula: | C14H9Cl3 |
Canonical SMILES: | C1=CC(=CC=C1C(=CCl)C2=CC=C(C=C2)Cl)Cl |
InChI: | InChI=1S/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H |
InChI Key: | LNKQQZFLNUVWQQ-UHFFFAOYSA-N |
Boiling Point: | 365.36°C at 760 mmHg |
Melting Point: | 68-69°C |
Density: | 1.2452 g/cm3 |
GHS Hazard Statement: | H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]; H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 281.976983 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 281.976983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 6.1 |
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