Home Halogens Phenol, 2,4,6-trichloro-, 1-acetate

Phenol, 2,4,6-trichloro-, 1-acetate

CAS No.:
23399-90-8
Catalog Number:
AG002N2T
Molecular Formula:
C8H5Cl3O2
Molecular Weight:
239.4831
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Product Description
Catalog Number:
AG002N2T
Chemical Name:
Phenol, 2,4,6-trichloro-, 1-acetate
CAS Number:
23399-90-8
Molecular Formula:
C8H5Cl3O2
Molecular Weight:
239.4831
MDL Number:
MFCD01632750
IUPAC Name:
(2,4,6-trichlorophenyl) acetate
InChI:
InChI=1S/C8H5Cl3O2/c1-4(12)13-8-6(10)2-5(9)3-7(8)11/h2-3H,1H3
InChI Key:
RFOCPJZGJNKBOI-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1c(Cl)cc(cc1Cl)Cl
NSC Number:
21474
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.936g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.476g/mol
Monoisotopic Mass:
237.936g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties