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79543-51-4 | Benzoyl chloride, 2-hydroxy-3,4,5-triiodo-
CAS No: 79543-51-4 Catalog No: AG0051DT MDL No:
Product Description
Catalog Number:
AG0051DT
Chemical Name:
Benzoyl chloride, 2-hydroxy-3,4,5-triiodo-
CAS Number:
79543-51-4
Molecular Formula:
C7H2ClI3O2
Molecular Weight:
534.2560
IUPAC Name:
2-hydroxy-3,4,5-triiodobenzoyl chloride
InChI:
InChI=1S/C7H2ClI3O2/c8-7(13)2-1-3(9)4(10)5(11)6(2)12/h1,12H
InChI Key:
GPLZGMJYXHSTRH-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(I)c(c(c1O)I)I
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
533.688g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
534.254g/mol
Monoisotopic Mass:
533.688g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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