Home Carboxys ethyl 4-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylate

ethyl 4-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylate

CAS No.:
153787-16-7
Catalog Number:
AG01BS28
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BS28
Chemical Name:
ethyl 4-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylate
CAS Number:
153787-16-7
MDL Number:
MFCD27421704
IUPAC Name:
ethyl 4-oxo-2,3-dihydrochromene-3-carboxylate
InChI:
InChI=1S/C12H12O4/c1-2-15-12(14)9-7-16-10-6-4-3-5-8(10)11(9)13/h3-6,9H,2,7H2,1H3
InChI Key:
WBTNJXOCKWYEAJ-UHFFFAOYSA-N
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.224g/mol
Monoisotopic Mass:
220.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties