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20021-12-9 | Propanoic acid, 2-(2,4-dichloro-6-methylphenoxy)-
CAS No: 20021-12-9 Catalog No: AG002CMX MDL No:
Product Description
Catalog Number:
AG002CMX
Chemical Name:
Propanoic acid, 2-(2,4-dichloro-6-methylphenoxy)-
CAS Number:
20021-12-9
Molecular Formula:
C10H10Cl2O3
Molecular Weight:
249.0906
IUPAC Name:
2-(2,4-dichloro-6-methylphenoxy)propanoic acid
InChI:
InChI=1S/C10H10Cl2O3/c1-5-3-7(11)4-8(12)9(5)15-6(2)10(13)14/h3-4,6H,1-2H3,(H,13,14)
InChI Key:
VUEYDEGVOQIELL-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c(c(c1)Cl)OC(C(=O)O)C
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.001g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.087g/mol
Monoisotopic Mass:
248.001g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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