Home Halogens 2,4,6-trichloro-3-methoxyphenol

2,4,6-trichloro-3-methoxyphenol

CAS No.:
26378-18-7
Catalog Number:
AG01C6GX
Molecular Formula:
C7H5Cl3O2
Molecular Weight:
227.4724
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Product Description
Catalog Number:
AG01C6GX
Chemical Name:
2,4,6-trichloro-3-methoxyphenol
CAS Number:
26378-18-7
Molecular Formula:
C7H5Cl3O2
Molecular Weight:
227.4724
MDL Number:
MFCD29991509
IUPAC Name:
2,4,6-trichloro-3-methoxyphenol
InChI:
InChI=1S/C7H5Cl3O2/c1-12-7-4(9)2-3(8)6(11)5(7)10/h2,11H,1H3
InChI Key:
CKMBXEUDRVYVLB-UHFFFAOYSA-N
SMILES:
COc1c(Cl)cc(c(c1Cl)O)Cl
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.936g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.465g/mol
Monoisotopic Mass:
225.936g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Investigations of the reactions of monochloramine and dichloramine with selected phenols: examination of humic acid models and water contaminants. Environmental science & technology 20041001
Properties