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29670-84-6 | Acetic acid, 2-(2,4-dichlorophenoxy)-, 2,3,3-trichloro-2-propen-1-yl ester
CAS No: 29670-84-6 Catalog No: AG002Z2E MDL No:
Product Description
Catalog Number:
AG002Z2E
Chemical Name:
Acetic acid, 2-(2,4-dichlorophenoxy)-, 2,3,3-trichloro-2-propen-1-yl ester
CAS Number:
29670-84-6
Molecular Formula:
C11H7Cl5O3
Molecular Weight:
364.4365
IUPAC Name:
2,3,3-trichloroprop-2-enyl 2-(2,4-dichlorophenoxy)acetate
InChI:
InChI=1S/C11H7Cl5O3/c12-6-1-2-9(7(13)3-6)18-5-10(17)19-4-8(14)11(15)16/h1-3H,4-5H2
InChI Key:
ISHBTWWXJNTDFW-UHFFFAOYSA-N
SMILES:
O=C(COc1ccc(cc1Cl)Cl)OCC(=C(Cl)Cl)Cl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.881g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.424g/mol
Monoisotopic Mass:
361.884g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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