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113372-81-9 | Phenol, 4-ethyl-2,6-diiodo-
CAS No: 113372-81-9 Catalog No: AG007SJI MDL No:
Product Description
Catalog Number:
AG007SJI
Chemical Name:
Phenol, 4-ethyl-2,6-diiodo-
CAS Number:
113372-81-9
Molecular Formula:
C8H8I2O
Molecular Weight:
373.9575
IUPAC Name:
4-ethyl-2,6-diiodophenol
InChI:
InChI=1S/C8H8I2O/c1-2-5-3-6(9)8(11)7(10)4-5/h3-4,11H,2H2,1H3
InChI Key:
OOTTUGRQLSZESX-UHFFFAOYSA-N
SMILES:
CCc1cc(I)c(c(c1)I)O
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.866g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.96g/mol
Monoisotopic Mass:
373.866g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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