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72240-47-2 | 9H-Xanthene-9-carboxaldehyde
CAS No: 72240-47-2 Catalog No: AG005J3O MDL No:
Product Description
Catalog Number:
AG005J3O
Chemical Name:
9H-Xanthene-9-carboxaldehyde
CAS Number:
72240-47-2
Molecular Formula:
C14H10O2
Molecular Weight:
210.2280
IUPAC Name:
9H-xanthene-9-carbaldehyde
InChI:
InChI=1S/C14H10O2/c15-9-12-10-5-1-3-7-13(10)16-14-8-4-2-6-11(12)14/h1-9,12H
InChI Key:
VMTBVSIWYXRQED-UHFFFAOYSA-N
SMILES:
O=CC1c2ccccc2Oc2c1cccc2
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.068g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.232g/mol
Monoisotopic Mass:
210.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| A novel two-carbon homologation with N-vinylacetamides and ethyl vinyl ether as acetaldehyde anion equivalents in the synthesis of 9H-xanthene, 9H-thioxanthene, and 9,10-dihydro-9-acridine carboxaldehydes. | The Journal of organic chemistry 20040123 |
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