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19514-91-1 | 1,3-Benzenediol, 4,6-diiodo-
CAS No: 19514-91-1 Catalog No: AG007RDE MDL No:MFCD22042855
Product Description
Catalog Number:
AG007RDE
Chemical Name:
1,3-Benzenediol, 4,6-diiodo-
CAS Number:
19514-91-1
Molecular Formula:
C6H4I2O2
Molecular Weight:
361.9037
MDL Number:
MFCD22042855
IUPAC Name:
4,6-diiodobenzene-1,3-diol
InChI:
InChI=1S/C6H4I2O2/c7-3-1-4(8)6(10)2-5(3)9/h1-2,9-10H
InChI Key:
SSHVWMSAUIZKKM-UHFFFAOYSA-N
SMILES:
Ic1cc(I)c(cc1O)O
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.83g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.905g/mol
Monoisotopic Mass:
361.83g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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