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141289-99-8 | Propanoic acid, 2-(3-methoxyphenoxy)-, ethyl ester
CAS No: 141289-99-8 Catalog No: AG001G60 MDL No:MFCD16089521
Product Description
Catalog Number:
AG001G60
Chemical Name:
Propanoic acid, 2-(3-methoxyphenoxy)-, ethyl ester
CAS Number:
141289-99-8
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
MDL Number:
MFCD16089521
IUPAC Name:
ethyl 2-(3-methoxyphenoxy)propanoate
InChI:
InChI=1S/C12H16O4/c1-4-15-12(13)9(2)16-11-7-5-6-10(8-11)14-3/h5-9H,4H2,1-3H3
InChI Key:
HZWBLFWDSWTRPC-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Oc1cccc(c1)OC)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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