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2314-30-9 | Benzonitrile, 2-hydroxy-3,5-diiodo-
CAS No: 2314-30-9 Catalog No: AG002MBL MDL No:
Product Description
Catalog Number:
AG002MBL
Chemical Name:
Benzonitrile, 2-hydroxy-3,5-diiodo-
CAS Number:
2314-30-9
Molecular Formula:
C7H3I2NO
Molecular Weight:
370.9138
IUPAC Name:
2-hydroxy-3,5-diiodobenzonitrile
InChI:
InChI=1S/C7H3I2NO/c8-5-1-4(3-10)7(11)6(9)2-5/h1-2,11H
InChI Key:
FNNNLVLLTDINFG-UHFFFAOYSA-N
SMILES:
N#Cc1cc(I)cc(c1O)I
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.83g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.916g/mol
Monoisotopic Mass:
370.83g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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