Home Halogens 2-(3,5-dichlorophenoxy)acetic acid

2-(3,5-dichlorophenoxy)acetic acid

CAS No.:
587-64-4
Catalog Number:
AG00EKUU
Molecular Formula:
C8H6Cl2O3
Molecular Weight:
221.0374
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Product Description
Catalog Number:
AG00EKUU
Chemical Name:
2-(3,5-dichlorophenoxy)acetic acid
CAS Number:
587-64-4
Molecular Formula:
C8H6Cl2O3
Molecular Weight:
221.0374
MDL Number:
MFCD04037337
IUPAC Name:
2-(3,5-dichlorophenoxy)acetic acid
InChI:
InChI=1S/C8H6Cl2O3/c9-5-1-6(10)3-7(2-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
LXWGIMHMQOCPCR-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cc(Cl)cc(c1)Cl
NSC Number:
190561
Properties
Complexity:
176  
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:
2.8  
Properties