CAS 16808-41-6 | 1H-Isoindole-1,3(2H)-dione, 2-tricyclo[3.3.1.13,7]dec-1-yl- | CAS Number 16808-41-6

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16808-41-6 | 1H-Isoindole-1,3(2H)-dione, 2-tricyclo[3.3.1.13,7]dec-1-yl-

CAS No: 16808-41-6 Catalog No: AG001XSS MDL No:MFCD01936819

Product Description

Catalog Number:

AG001XSS

Chemical Name:

1H-Isoindole-1,3(2H)-dione, 2-tricyclo[3.3.1.13,7]dec-1-yl-

CAS Number:

16808-41-6

Molecular Formula:

C18H19NO2

Molecular Weight:

281.3490

MDL Number:

MFCD01936819

IUPAC Name:

2-(1-adamantyl)isoindole-1,3-dione

InChI:

InChI=1S/C18H19NO2/c20-16-14-3-1-2-4-15(14)17(21)19(16)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2

InChI Key:

NNPFLBWYAZEFOL-UHFFFAOYSA-N

SMILES:

O=C1N(C(=O)c2c1cccc2)C12CC3CC(C2)CC(C1)C3

Properties

Complexity:

446

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.355g/mol

Monoisotopic Mass:

281.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Photoinduced decarboxylation of 3-(N-phthalimido)adamantane-1-carboxylic acid and radical addition to electron deficient alkenes.	Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20110401
Novel 2,4-methanoadamantane-benzazepine by domino photochemistry of N-(1-adamantyl)phthalimide.	Organic letters 20080918
Anticonvulsant phenytoinergic pharmacophores and anti-HIV activity--preliminary evidence for the dual requirement of the 4-aminophthalimide platform and the N-(1-adamantyl) substitution for antiviral properties.	Life sciences 19980101