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1928-55-8 | Acetic acid, 2-(3,4-dichlorophenoxy)-, methyl ester
CAS No: 1928-55-8 Catalog No: AG01F8VA MDL No:
Product Description
Catalog Number:
AG01F8VA
Chemical Name:
Acetic acid, 2-(3,4-dichlorophenoxy)-, methyl ester
CAS Number:
1928-55-8
Molecular Formula:
C9H8Cl2O3
Molecular Weight:
235.0640
IUPAC Name:
methyl 2-(3,4-dichlorophenoxy)acetate
InChI:
InChI=1S/C9H8Cl2O3/c1-13-9(12)5-14-6-2-3-7(10)8(11)4-6/h2-4H,5H2,1H3
InChI Key:
DOMYNIJHLOOSIU-UHFFFAOYSA-N
SMILES:
COC(=O)COc1ccc(c(c1)Cl)Cl
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.985g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.06g/mol
Monoisotopic Mass:
233.985g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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