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141126-82-1 | Acetic acid, 2-(2-ethoxy-6-formylphenoxy)-
CAS No: 141126-82-1 Catalog No: AG001FYC MDL No:MFCD03906073
Product Description
Catalog Number:
AG001FYC
Chemical Name:
Acetic acid, 2-(2-ethoxy-6-formylphenoxy)-
CAS Number:
141126-82-1
Molecular Formula:
C11H12O5
Molecular Weight:
224.2100
MDL Number:
MFCD03906073
IUPAC Name:
2-(2-ethoxy-6-formylphenoxy)acetic acid
InChI:
InChI=1S/C11H12O5/c1-2-15-9-5-3-4-8(6-12)11(9)16-7-10(13)14/h3-6H,2,7H2,1H3,(H,13,14)
InChI Key:
YPPIUPDVZUCYEI-UHFFFAOYSA-N
SMILES:
CCOc1cccc(c1OCC(=O)O)C=O
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.068g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.212g/mol
Monoisotopic Mass:
224.068g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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