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4444-74-0

4444-74-0 | 2H-1-Benzopyran-6-carboxaldehyde,7-methoxy-2-oxo-

CAS No: 4444-74-0 Catalog No: AG0071RN MDL No:

Product Description

Catalog Number:
AG0071RN
Chemical Name:
2H-1-Benzopyran-6-carboxaldehyde,7-methoxy-2-oxo-
CAS Number:
4444-74-0
Molecular Formula:
C11H8O4
Molecular Weight:
204.1788
IUPAC Name:
7-methoxy-2-oxochromene-6-carbaldehyde
InChI:
InChI=1S/C11H8O4/c1-14-9-5-10-7(4-8(9)6-12)2-3-11(13)15-10/h2-6H,1H3
InChI Key:
JZYCZVLVWUCHTP-UHFFFAOYSA-N
SMILES:
COc1cc2oc(=O)ccc2cc1C=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:
204.042g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.181g/mol
Monoisotopic Mass:
204.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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