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13064-64-7 | 1,4-Benzenediol, 2,5-diiodo-
CAS No: 13064-64-7 Catalog No: AG000UQX MDL No:MFCD09910095
Product Description
Catalog Number:
AG000UQX
Chemical Name:
1,4-Benzenediol, 2,5-diiodo-
CAS Number:
13064-64-7
Molecular Formula:
C6H4I2O2
Molecular Weight:
361.9037
MDL Number:
MFCD09910095
IUPAC Name:
2,5-diiodobenzene-1,4-diol
InChI:
InChI=1S/C6H4I2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,9-10H
InChI Key:
XDLGDTUOWIFMQC-UHFFFAOYSA-N
SMILES:
Oc1cc(I)c(cc1I)O
Properties
Complexity:
106
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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