Home Other Building Blocks 4-(3-formylphenoxy)butanoic acid

4-(3-formylphenoxy)butanoic acid

CAS No.:
174884-10-7
Catalog Number:
AG01A7P8
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
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Product Description
Catalog Number:
AG01A7P8
Chemical Name:
4-(3-formylphenoxy)butanoic acid
CAS Number:
174884-10-7
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
MDL Number:
MFCD09673366
IUPAC Name:
4-(3-formylphenoxy)butanoic acid
InChI:
InChI=1S/C11H12O4/c12-8-9-3-1-4-10(7-9)15-6-2-5-11(13)14/h1,3-4,7-8H,2,5-6H2,(H,13,14)
InChI Key:
QHLKXVXBJDXSHQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCCCC(=O)O
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties