Home Other Building Blocks 4-[4-(benzyloxy)phenyl]-4-oxobutanoic acid

4-[4-(benzyloxy)phenyl]-4-oxobutanoic acid

CAS No.:
6686-25-5
Catalog Number:
AG01BRYU
Molecular Formula:
C17H16O4
Molecular Weight:
284.3065
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Product Description
Catalog Number:
AG01BRYU
Chemical Name:
4-[4-(benzyloxy)phenyl]-4-oxobutanoic acid
CAS Number:
6686-25-5
Molecular Formula:
C17H16O4
Molecular Weight:
284.3065
MDL Number:
MFCD14535718
IUPAC Name:
4-oxo-4-(4-phenylmethoxyphenyl)butanoic acid
InChI:
InChI=1S/C17H16O4/c18-16(10-11-17(19)20)14-6-8-15(9-7-14)21-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,19,20)
InChI Key:
BASURFQVOZJAFE-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)OCc1ccccc1)CCC(=O)O
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.105g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.311g/mol
Monoisotopic Mass:
284.105g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties