Home Other Building Blocks 4-(4-Methoxy-3-methylphenyl)-4-oxobutanoic acid

4-(4-Methoxy-3-methylphenyl)-4-oxobutanoic acid

CAS No.:
33446-14-9
Catalog Number:
AG00BZVS
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$392
- +
1g
95%
1 week
United States
$923
- +
Product Description
Catalog Number:
AG00BZVS
Chemical Name:
4-(4-Methoxy-3-methylphenyl)-4-oxobutanoic acid
CAS Number:
33446-14-9
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD07186514
IUPAC Name:
4-(4-methoxy-3-methylphenyl)-4-oxobutanoic acid
InChI:
InChI=1S/C12H14O4/c1-8-7-9(3-5-11(8)16-2)10(13)4-6-12(14)15/h3,5,7H,4,6H2,1-2H3,(H,14,15)
InChI Key:
WNNVNQBKNSPKPP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C)C(=O)CCC(=O)O
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties