Home Halogens Acetic acid, 2-(2,3-dichlorophenoxy)-

Acetic acid, 2-(2,3-dichlorophenoxy)-

CAS No.:
2976-74-1
Catalog Number:
AG002ZBQ
Molecular Formula:
C8H6Cl2O3
Molecular Weight:
221.0374
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Product Description
Catalog Number:
AG002ZBQ
Chemical Name:
Acetic acid, 2-(2,3-dichlorophenoxy)-
CAS Number:
2976-74-1
Molecular Formula:
C8H6Cl2O3
Molecular Weight:
221.0374
MDL Number:
MFCD00004299
IUPAC Name:
2-(2,3-dichlorophenoxy)acetic acid
InChI:
InChI=1S/C8H6Cl2O3/c9-5-2-1-3-6(8(5)10)13-4-7(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
RBJIGQRZLITQJG-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cccc(c1Cl)Cl
EC Number:
221-022-9
NSC Number:
74462
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.969g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.033g/mol
Monoisotopic Mass:
219.969g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Pesticides in surface drinking-water supplies of the northern Great Plains. Environmental health perspectives 20070801
CYP94A1, a plant cytochrome P450-catalyzing fatty acid omega-hydroxylase, is selectively induced by chemical stress in Vicia sativa seedlings. Planta 20050801
Properties