Home Other Building Blocks 3-(4-acetyl-2-methoxyphenoxy)propanoic acid

3-(4-acetyl-2-methoxyphenoxy)propanoic acid

CAS No.:
170170-51-1
Catalog Number:
AG019VBV
Molecular Formula:
C12H14O5
Molecular Weight:
238.2366
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Product Description
Catalog Number:
AG019VBV
Chemical Name:
3-(4-acetyl-2-methoxyphenoxy)propanoic acid
CAS Number:
170170-51-1
Molecular Formula:
C12H14O5
Molecular Weight:
238.2366
MDL Number:
MFCD09046112
IUPAC Name:
3-(4-acetyl-2-methoxyphenoxy)propanoic acid
InChI:
InChI=1S/C12H14O5/c1-8(13)9-3-4-10(11(7-9)16-2)17-6-5-12(14)15/h3-4,7H,5-6H2,1-2H3,(H,14,15)
InChI Key:
GZCAZDATCFYBEF-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OCCC(=O)O)C(=O)C
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.084g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.239g/mol
Monoisotopic Mass:
238.084g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties