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Home > Aldehydes > 142209-30-1
142209-30-1 | Benzaldehyde, 2-[(2-oxo-2H-1-benzopyran-3-yl)methoxy]-
CAS No: 142209-30-1 Catalog No: AG001HYR MDL No:
Product Description
Catalog Number:
AG001HYR
Chemical Name:
Benzaldehyde, 2-[(2-oxo-2H-1-benzopyran-3-yl)methoxy]-
CAS Number:
142209-30-1
Molecular Formula:
C17H12O4
Molecular Weight:
280.2748
IUPAC Name:
2-[(2-oxochromen-3-yl)methoxy]benzaldehyde
InChI:
InChI=1S/C17H12O4/c18-10-13-6-2-3-7-15(13)20-11-14-9-12-5-1-4-8-16(12)21-17(14)19/h1-10H,11H2
InChI Key:
JQGHUNIWQKXESA-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCc1cc2ccccc2oc1=O
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.074g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.279g/mol
Monoisotopic Mass:
280.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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