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Home > Aldehydes > 143662-58-2
143662-58-2 | Benzaldehyde, 4-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-
CAS No: 143662-58-2 Catalog No: AG006U8N MDL No:
Product Description
Catalog Number:
AG006U8N
Chemical Name:
Benzaldehyde, 4-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-
CAS Number:
143662-58-2
Molecular Formula:
C16H10O3
Molecular Weight:
250.2488
IUPAC Name:
4-(1,3-dioxoinden-2-yl)benzaldehyde
InChI:
InChI=1S/C16H10O3/c17-9-10-5-7-11(8-6-10)14-15(18)12-3-1-2-4-13(12)16(14)19/h1-9,14H
InChI Key:
AYNWTBRWIUVJOI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.063g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.253g/mol
Monoisotopic Mass:
250.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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