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224641-82-1

224641-82-1 | Benzaldehyde, 3-hydroxy-2,4,6-triiodo-

CAS No: 224641-82-1 Catalog No: AG006XSH MDL No:

Product Description

Catalog Number:
AG006XSH
Chemical Name:
Benzaldehyde, 3-hydroxy-2,4,6-triiodo-
CAS Number:
224641-82-1
Molecular Formula:
C7H3I3O2
Molecular Weight:
499.8109
IUPAC Name:
3-hydroxy-2,4,6-triiodobenzaldehyde
InChI:
InChI=1S/C7H3I3O2/c8-4-1-5(9)7(12)6(10)3(4)2-11/h1-2,12H
InChI Key:
PYEXBDXARWXOHC-UHFFFAOYSA-N
SMILES:
O=Cc1c(I)cc(c(c1I)O)I
NSC Number:
41710

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
499.727g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
499.812g/mol
Monoisotopic Mass:
499.727g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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