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16870-28-3 | Benzoic acid, 2-hydroxy-4-iodo-
CAS No: 16870-28-3 Catalog No: AG001Y95 MDL No:MFCD00061127
Product Description
Catalog Number:
AG001Y95
Chemical Name:
Benzoic acid, 2-hydroxy-4-iodo-
CAS Number:
16870-28-3
Molecular Formula:
C7H5IO3
Molecular Weight:
264.0173
MDL Number:
MFCD00061127
IUPAC Name:
2-hydroxy-4-iodobenzoic acid
InChI:
InChI=1S/C7H5IO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,(H,10,11)
InChI Key:
UQOZVZTUJNRMBV-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)O)C(=O)O
NSC Number:
109096
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.928g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.018g/mol
Monoisotopic Mass:
263.928g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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