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Home Other Building Blocks 3-Phenoxyphenylacetic acid

3-Phenoxyphenylacetic acid

CAS No.:
32852-81-6
Catalog Number:
AG0033S1
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%forsynthesis
In Stock USA
United States
$162
- +
Product Description
Catalog Number:
AG0033S1
Chemical Name:
3-Phenoxyphenylacetic acid
CAS Number:
32852-81-6
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
MDL Number:
MFCD00016826
IUPAC Name:
2-(3-phenoxyphenyl)acetic acid
InChI:
InChI=1S/C14H12O3/c15-14(16)10-11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9H,10H2,(H,15,16)
InChI Key:
LEMRHTTWKDVQEI-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1)Oc1ccccc1
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Ethers of 3-hydroxyphenylacetic acid as selective gamma-hydroxybutyric acid receptor ligands. Bioorganic & medicinal chemistry letters 20050701
Properties