Home Other Building Blocks ethyl 4-(2-hydroxyphenyl)-2,4-dioxobutanoate

ethyl 4-(2-hydroxyphenyl)-2,4-dioxobutanoate

CAS No.:
4940-37-8
Catalog Number:
AG01C3H8
Molecular Formula:
C12H12O5
Molecular Weight:
236.2207
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Product Description
Catalog Number:
AG01C3H8
Chemical Name:
ethyl 4-(2-hydroxyphenyl)-2,4-dioxobutanoate
CAS Number:
4940-37-8
Molecular Formula:
C12H12O5
Molecular Weight:
236.2207
MDL Number:
MFCD02727521
IUPAC Name:
ethyl 4-(2-hydroxyphenyl)-2,4-dioxobutanoate
InChI:
InChI=1S/C12H12O5/c1-2-17-12(16)11(15)7-10(14)8-5-3-4-6-9(8)13/h3-6,13H,2,7H2,1H3
InChI Key:
PSFPQJSCHOSMAE-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)CC(=O)c1ccccc1O
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.068g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.223g/mol
Monoisotopic Mass:
236.068g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties