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898777-36-1 | ETHYL 8-(3-IODOPHENYL)-8-OXOOCTANOATE
CAS No: 898777-36-1 Catalog No: AG00GZF5 MDL No:
Product Description
Catalog Number:
AG00GZF5
Chemical Name:
ETHYL 8-(3-IODOPHENYL)-8-OXOOCTANOATE
CAS Number:
898777-36-1
IUPAC Name:
ethyl 8-(3-iodophenyl)-8-oxooctanoate
InChI:
InChI=1S/C16H21IO3/c1-2-20-16(19)11-6-4-3-5-10-15(18)13-8-7-9-14(17)12-13/h7-9,12H,2-6,10-11H2,1H3
InChI Key:
QAAFROJXIUATIC-UHFFFAOYSA-N
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.054g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.245g/mol
Monoisotopic Mass:
388.054g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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