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53586-99-5 | 12-Hydroxy-9,10-diiodo-9-octadecenoic acid
CAS No: 53586-99-5 Catalog No: AG00DYIL MDL No:
Product Description
Catalog Number:
AG00DYIL
Chemical Name:
12-Hydroxy-9,10-diiodo-9-octadecenoic acid
CAS Number:
53586-99-5
IUPAC Name:
(E)-12-hydroxy-9,10-diiodooctadec-9-enoic acid
InChI:
InChI=1S/C18H32I2O3/c1-2-3-4-8-11-15(21)14-17(20)16(19)12-9-6-5-7-10-13-18(22)23/h15,21H,2-14H2,1H3,(H,22,23)/b17-16+
InChI Key:
CWOAAWNTQUVQLN-WUKNDPDISA-N
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
550.044g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
550.26g/mol
Monoisotopic Mass:
550.044g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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