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Home > Aldehydes > 104079-37-0
104079-37-0 | 1H-Indene-2-acetaldehyde, 2,3-dihydro-1,3-dioxo-2-phenyl-
CAS No: 104079-37-0 Catalog No: AG007F1W MDL No:
Product Description
Catalog Number:
AG007F1W
Chemical Name:
1H-Indene-2-acetaldehyde, 2,3-dihydro-1,3-dioxo-2-phenyl-
CAS Number:
104079-37-0
Molecular Formula:
C17H12O3
Molecular Weight:
264.2754
IUPAC Name:
2-(1,3-dioxo-2-phenylinden-2-yl)acetaldehyde
InChI:
InChI=1S/C17H12O3/c18-11-10-17(12-6-2-1-3-7-12)15(19)13-8-4-5-9-14(13)16(17)20/h1-9,11H,10H2
InChI Key:
DKOSUQGUSBHBEW-UHFFFAOYSA-N
SMILES:
O=CCC1(c2ccccc2)C(=O)c2c(C1=O)cccc2
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.079g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.28g/mol
Monoisotopic Mass:
264.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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