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Home > Indoles and Oxindole > 3308-99-4
3308-99-4 | 1H-Isoindole-1,3(2H)-dione, 2-[3-(2-phenyl-1,3-dioxolan-2-yl)propyl]-
CAS No: 3308-99-4 Catalog No: AG00I6DY MDL No:MFCD20483779
Product Description
Catalog Number:
AG00I6DY
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-[3-(2-phenyl-1,3-dioxolan-2-yl)propyl]-
CAS Number:
3308-99-4
Molecular Formula:
C20H19NO4
Molecular Weight:
337.3692
MDL Number:
MFCD20483779
IUPAC Name:
2-[3-(2-phenyl-1,3-dioxolan-2-yl)propyl]isoindole-1,3-dione
InChI:
InChI=1S/C20H19NO4/c22-18-16-9-4-5-10-17(16)19(23)21(18)12-6-11-20(24-13-14-25-20)15-7-2-1-3-8-15/h1-5,7-10H,6,11-14H2
InChI Key:
KKIJKUYDQHEHRO-UHFFFAOYSA-N
SMILES:
O=C1N(CCCC2(OCCO2)c2ccccc2)C(=O)c2c1cccc2
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.131g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.375g/mol
Monoisotopic Mass:
337.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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