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959771-81-4 | 4-Iodopicolinic acid hydroiodide
CAS No: 959771-81-4 Catalog No: AG00IJPE MDL No:MFCD06738838
Product Description
Catalog Number:
AG00IJPE
Chemical Name:
4-Iodopicolinic acid hydroiodide
CAS Number:
959771-81-4
Molecular Formula:
C6H5I2NO2
Molecular Weight:
376.9183
MDL Number:
MFCD06738838
IUPAC Name:
4-iodopyridine-2-carboxylic acid;hydroiodide
InChI:
InChI=1S/C6H4INO2.HI/c7-4-1-2-8-5(3-4)6(9)10;/h1-3H,(H,9,10);1H
InChI Key:
RNQAFQCXISTQJB-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(I)ccn1.I
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.841g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
376.92g/mol
Monoisotopic Mass:
376.841g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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