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Home > Aldehydes > 820209-61-8
820209-61-8 | Benzaldehyde, 5-methoxy-2-(6-methyl-2-oxo-2H-1-benzopyran-4-yl)-
CAS No: 820209-61-8 Catalog No: AG004YTS MDL No:
Product Description
Catalog Number:
AG004YTS
Chemical Name:
Benzaldehyde, 5-methoxy-2-(6-methyl-2-oxo-2H-1-benzopyran-4-yl)-
CAS Number:
820209-61-8
Molecular Formula:
C18H14O4
Molecular Weight:
294.3014
IUPAC Name:
5-methoxy-2-(6-methyl-2-oxochromen-4-yl)benzaldehyde
InChI:
InChI=1S/C18H14O4/c1-11-3-6-17-16(7-11)15(9-18(20)22-17)14-5-4-13(21-2)8-12(14)10-19/h3-10H,1-2H3
InChI Key:
KEGYLZCPOQFFBJ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)ccc1c1cc(=O)oc2c1cc(C)cc2
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.089g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.306g/mol
Monoisotopic Mass:
294.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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