Home Other Building Blocks Ethyl 2-phenoxyacetoacetate

Ethyl 2-phenoxyacetoacetate

CAS No.:
7699-83-4
Catalog Number:
AG008OBV
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$163
- +
1g
1 week
United States
$288
- +
Product Description
Catalog Number:
AG008OBV
Chemical Name:
Ethyl 2-phenoxyacetoacetate
CAS Number:
7699-83-4
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD10568343
IUPAC Name:
ethyl 3-oxo-2-phenoxybutanoate
InChI:
InChI=1S/C12H14O4/c1-3-15-12(14)11(9(2)13)16-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChI Key:
ZXLFQGWHCIRDIM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)C)Oc1ccccc1
Properties
Complexity:
243  
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:
0
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties