Home Aldehydes 2H-1-Benzopyran-3-carboxaldehyde, 4-hydroxy-6-methyl-2-oxo-

2H-1-Benzopyran-3-carboxaldehyde, 4-hydroxy-6-methyl-2-oxo-

CAS No.:
126214-23-1
Catalog Number:
AG000SCU
Molecular Formula:
C11H8O4
Molecular Weight:
204.1788
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Product Description
Catalog Number:
AG000SCU
Chemical Name:
2H-1-Benzopyran-3-carboxaldehyde, 4-hydroxy-6-methyl-2-oxo-
CAS Number:
126214-23-1
Molecular Formula:
C11H8O4
Molecular Weight:
204.1788
MDL Number:
MFCD02683795
IUPAC Name:
4-hydroxy-6-methyl-2-oxochromene-3-carbaldehyde
InChI:
InChI=1S/C11H8O4/c1-6-2-3-9-7(4-6)10(13)8(5-12)11(14)15-9/h2-5,13H,1H3
InChI Key:
GNJLDOHIPVFYTM-UHFFFAOYSA-N
SMILES:
O=Cc1c(=O)oc2c(c1O)cc(cc2)C
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.042g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.181g/mol
Monoisotopic Mass:
204.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties