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116995-18-7 | Benzene, 1,2,4,5-tetrachloro-3-(2,4-dichlorophenoxy)-
CAS No: 116995-18-7 Catalog No: AG000DH0 MDL No:
Product Description
Catalog Number:
AG000DH0
Chemical Name:
Benzene, 1,2,4,5-tetrachloro-3-(2,4-dichlorophenoxy)-
CAS Number:
116995-18-7
Molecular Formula:
C12H4Cl6O
Molecular Weight:
376.8776
IUPAC Name:
1,2,4,5-tetrachloro-3-(2,4-dichlorophenoxy)benzene
InChI:
InChI=1S/C12H4Cl6O/c13-5-1-2-9(6(14)3-5)19-12-10(17)7(15)4-8(16)11(12)18/h1-4H
InChI Key:
DIBYIHMYEPMGKC-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Oc1c(Cl)c(Cl)cc(c1Cl)Cl
UNII:
SV131X1K0A
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.836g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.863g/mol
Monoisotopic Mass:
373.839g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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