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88140-30-1

88140-30-1 | 2H-1-Benzopyran-8-carboxaldehyde, 5,7-dimethoxy-2-oxo-

CAS No: 88140-30-1 Catalog No: AG004DAD MDL No:

Product Description

Catalog Number:
AG004DAD
Chemical Name:
2H-1-Benzopyran-8-carboxaldehyde, 5,7-dimethoxy-2-oxo-
CAS Number:
88140-30-1
Molecular Formula:
C12H10O5
Molecular Weight:
234.2048
IUPAC Name:
5,7-dimethoxy-2-oxochromene-8-carbaldehyde
InChI:
InChI=1S/C12H10O5/c1-15-9-5-10(16-2)8(6-13)12-7(9)3-4-11(14)17-12/h3-6H,1-2H3
InChI Key:
KXNJWEKEQVTBOI-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c2c(c1C=O)oc(=O)cc2

Properties

Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.053g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.207g/mol
Monoisotopic Mass:
234.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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