5,6-Dimethoxy-2-(2-phenylethyl)-1H-isoindole-1,3(2H)-dione

HCID 22757553
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Basic information

CAS
37508-20-6
Standard SMILES
COc1cc2c(cc1OC)C(=O)N(CCc1ccccc1)C2=O
InChIKey
ITTMKMBRJJZVNE-UHFFFAOYSA-N
Molecular formula
C18H17NO4
Average molar mass
311.3 g/mol
Monoisotopic mass
311.11575802

Names & identifiers

Preferred name
5,6-Dimethoxy-2-(2-phenylethyl)-1H-isoindole-1,3(2H)-dione
IUPAC
5,6-dimethoxy-2-(2-phenylethyl)isoindole-1,3-dione

Names & synonyms

37508-20-6SCHEMBL11635816DTXSID00628147ITTMKMBRJJZVNE-UHFFFAOYSA-N5,6-Dimethoxy-2-(2-phenylethyl)-1H-isoindole-1,3(2H)-dione4,5-dimethoxy-N-phenethyl phthalimide

Database identifiers

CAS
37508-20-6
PubChem CID
22757553
DTXSID
DTXSID00628147

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
23

Related reactions

1 records
New reaction record

Compound notes

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