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951886-73-0 | Ethyl 6-(5-Chloro-2-methoxyphenyl)-6-oxohexanoate
CAS No: 951886-73-0 Catalog No: AG01F9EE MDL No:
Product Description
Catalog Number:
AG01F9EE
Chemical Name:
Ethyl 6-(5-Chloro-2-methoxyphenyl)-6-oxohexanoate
CAS Number:
951886-73-0
Molecular Formula:
C15H19ClO4
Molecular Weight:
298.7620
IUPAC Name:
ethyl 6-(5-chloro-2-methoxyphenyl)-6-oxohexanoate
InChI:
InChI=1S/C15H19ClO4/c1-3-20-15(18)7-5-4-6-13(17)12-10-11(16)8-9-14(12)19-2/h8-10H,3-7H2,1-2H3
InChI Key:
LXCOPIYSIIQHOQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCC(=O)c1cc(Cl)ccc1OC
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.097g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.763g/mol
Monoisotopic Mass:
298.097g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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