Home Other Building Blocks 4-ethoxy-3,3-dimethyl-4-oxobutanoic acid

4-ethoxy-3,3-dimethyl-4-oxobutanoic acid

CAS No.:
32980-28-2
Catalog Number:
AG01BAWE
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
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Product Description
Catalog Number:
AG01BAWE
Chemical Name:
4-ethoxy-3,3-dimethyl-4-oxobutanoic acid
CAS Number:
32980-28-2
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD20638502
IUPAC Name:
4-ethoxy-3,3-dimethyl-4-oxobutanoic acid
InChI:
InChI=1S/C8H14O4/c1-4-12-7(11)8(2,3)5-6(9)10/h4-5H2,1-3H3,(H,9,10)
InChI Key:
FLEVJFVPZSFNCH-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC(=O)O)(C)C
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.196g/mol
Monoisotopic Mass:
174.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties