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25056-70-6 | Acetic acid, 2,2,2-trichloro-, 2-(2,4,5-trichlorophenoxy)ethyl ester
CAS No: 25056-70-6 Catalog No: AG002QAY MDL No:
Product Description
Catalog Number:
AG002QAY
Chemical Name:
Acetic acid, 2,2,2-trichloro-, 2-(2,4,5-trichlorophenoxy)ethyl ester
CAS Number:
25056-70-6
Molecular Formula:
C10H6Cl6O3
Molecular Weight:
386.8708
IUPAC Name:
2-(2,4,5-trichlorophenoxy)ethyl 2,2,2-trichloroacetate
InChI:
InChI=1S/C10H6Cl6O3/c11-5-3-7(13)8(4-6(5)12)18-1-2-19-9(17)10(14,15)16/h3-4H,1-2H2
InChI Key:
FFRUQSUMDFNBLG-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)(Cl)Cl)OCCOc1cc(Cl)c(cc1Cl)Cl
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.842g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.855g/mol
Monoisotopic Mass:
383.845g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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