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1838-55-7 | 4-(4-Hydroxyphenoxy)-3,5-diiodobenzoic acid
CAS No: 1838-55-7 Catalog No: AG00B3C8 MDL No:
Product Description
Catalog Number:
AG00B3C8
Chemical Name:
4-(4-Hydroxyphenoxy)-3,5-diiodobenzoic acid
CAS Number:
1838-55-7
IUPAC Name:
4-(4-hydroxyphenoxy)-3,5-diiodobenzoic acid
InChI:
InChI=1S/C13H8I2O4/c14-10-5-7(13(17)18)6-11(15)12(10)19-9-3-1-8(16)2-4-9/h1-6,16H,(H,17,18)
InChI Key:
LPNQFIJWELQLRO-UHFFFAOYSA-N
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
481.851g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
482.012g/mol
Monoisotopic Mass:
481.851g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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