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898790-95-9 | 5-(4-IODOPHENYL)-5-OXOVALERIC ACID
CAS No: 898790-95-9 Catalog No: AG00GZJY MDL No:
Product Description
Catalog Number:
AG00GZJY
Chemical Name:
5-(4-IODOPHENYL)-5-OXOVALERIC ACID
CAS Number:
898790-95-9
IUPAC Name:
5-(4-iodophenyl)-5-oxopentanoic acid
InChI:
InChI=1S/C11H11IO3/c12-9-6-4-8(5-7-9)10(13)2-1-3-11(14)15/h4-7H,1-3H2,(H,14,15)
InChI Key:
AJIJFBZEGHQKQL-UHFFFAOYSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.975g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.11g/mol
Monoisotopic Mass:
317.975g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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