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1914-66-5 | Propanoic acid, 2-(2,4-dichlorophenoxy)-2-methyl-
CAS No: 1914-66-5 Catalog No: AG002F7M MDL No:MFCD03422281
Product Description
Catalog Number:
AG002F7M
Chemical Name:
Propanoic acid, 2-(2,4-dichlorophenoxy)-2-methyl-
CAS Number:
1914-66-5
Molecular Formula:
C10H10Cl2O3
Molecular Weight:
249.0906
MDL Number:
MFCD03422281
IUPAC Name:
2-(2,4-dichlorophenoxy)-2-methylpropanoic acid
InChI:
InChI=1S/C10H10Cl2O3/c1-10(2,9(13)14)15-8-4-3-6(11)5-7(8)12/h3-5H,1-2H3,(H,13,14)
InChI Key:
DVCPZLUILSFNDO-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)OC(C(=O)O)(C)C
NSC Number:
71798
Properties
Complexity:
243
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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