Home Other Building Blocks methyl 4-(3-hydroxyphenyl)-2,4-dioxobutanoate

methyl 4-(3-hydroxyphenyl)-2,4-dioxobutanoate

CAS No.:
60640-63-3
Catalog Number:
AG01C51Q
Molecular Formula:
C11H10O5
Molecular Weight:
222.1941
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Product Description
Catalog Number:
AG01C51Q
Chemical Name:
methyl 4-(3-hydroxyphenyl)-2,4-dioxobutanoate
CAS Number:
60640-63-3
Molecular Formula:
C11H10O5
Molecular Weight:
222.1941
MDL Number:
MFCD29763269
IUPAC Name:
methyl 4-(3-hydroxyphenyl)-2,4-dioxobutanoate
InChI:
InChI=1S/C11H10O5/c1-16-11(15)10(14)6-9(13)7-3-2-4-8(12)5-7/h2-5,12H,6H2,1H3
InChI Key:
FKIUBGJCNKLEDS-UHFFFAOYSA-N
SMILES:
COC(=O)C(=O)CC(=O)c1cccc(c1)O
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.196g/mol
Monoisotopic Mass:
222.053g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties