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88208-98-4 | Benzeneheptanoic acid, 3,5-dimethoxy-, ethyl ester
CAS No: 88208-98-4 Catalog No: AG004DVZ MDL No:
Product Description
Catalog Number:
AG004DVZ
Chemical Name:
Benzeneheptanoic acid, 3,5-dimethoxy-, ethyl ester
CAS Number:
88208-98-4
Molecular Formula:
C17H26O4
Molecular Weight:
294.3859
IUPAC Name:
ethyl 7-(3,5-dimethoxyphenyl)heptanoate
InChI:
InChI=1S/C17H26O4/c1-4-21-17(18)10-8-6-5-7-9-14-11-15(19-2)13-16(12-14)20-3/h11-13H,4-10H2,1-3H3
InChI Key:
JAGBSYCGTMFPFK-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCCCc1cc(OC)cc(c1)OC
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.391g/mol
Monoisotopic Mass:
294.183g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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