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73279-02-4 | Benzaldehyde, 4-[3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)propoxy]-
CAS No: 73279-02-4 Catalog No: AG005PK8 MDL No:
Product Description
Catalog Number:
AG005PK8
Chemical Name:
Benzaldehyde, 4-[3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)propoxy]-
CAS Number:
73279-02-4
Molecular Formula:
C18H15NO4
Molecular Weight:
309.3160
IUPAC Name:
4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzaldehyde
InChI:
InChI=1S/C18H15NO4/c20-12-13-6-8-14(9-7-13)23-11-3-10-19-17(21)15-4-1-2-5-16(15)18(19)22/h1-2,4-9,12H,3,10-11H2
InChI Key:
WACIDFSJZAPASS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCCCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.1g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.321g/mol
Monoisotopic Mass:
309.1g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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