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22621-40-5 | methyl O-acetyl-5-iodosalicylate
CAS No: 22621-40-5 Catalog No: AG00CBX5 MDL No:
Product Description
Catalog Number:
AG00CBX5
Chemical Name:
methyl O-acetyl-5-iodosalicylate
CAS Number:
22621-40-5
IUPAC Name:
methyl 5-acetyloxy-2-iodobenzoate
InChI:
InChI=1S/C10H9IO4/c1-6(12)15-7-3-4-9(11)8(5-7)10(13)14-2/h3-5H,1-2H3
InChI Key:
HRVZFEACPOXONC-UHFFFAOYSA-N
EC Number:
245-136-3
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.955g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.082g/mol
Monoisotopic Mass:
319.955g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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