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124311-20-2

124311-20-2 | Phenol, 3-ethyl-2,4,6-triiodo-

CAS No: 124311-20-2 Catalog No: AG000LTQ MDL No:

Product Description

Catalog Number:
AG000LTQ
Chemical Name:
Phenol, 3-ethyl-2,4,6-triiodo-
CAS Number:
124311-20-2
Molecular Formula:
C8H7I3O
Molecular Weight:
499.8540
IUPAC Name:
3-ethyl-2,4,6-triiodophenol
InChI:
InChI=1S/C8H7I3O/c1-2-4-5(9)3-6(10)8(12)7(4)11/h3,12H,2H2,1H3
InChI Key:
LGECDBRPRCZUNH-UHFFFAOYSA-N
SMILES:
CCc1c(I)cc(c(c1I)O)I

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
499.763g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
499.856g/mol
Monoisotopic Mass:
499.763g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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