Phthalimide, N-(2-hydroxy-3-butyl)-

HCID 600337

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CC(O)C(C)N1C(=O)c2ccccc2C1=O
InChIKey: VVHCBWKXCDNJQN-UHFFFAOYSA-N
Molecular formula: C12H13NO3
Average molar mass: 219.24 g/mol

Names & identifiers

Preferred name: Phthalimide, N-(2-hydroxy-3-butyl)-
IUPAC: 2-(3-hydroxybutan-2-yl)isoindole-1,3-dione

Names & synonyms

Phthalimide, N-(2-hydroxy-3-butyl)-SCHEMBL5524122AKOS0174412292-(2-Hydroxy-1-methylpropyl)-1H-isoindole-1,3(2H)-dione2-(2-Hydroxy-1-methylpropyl)-1H-isoindole-1,3(2H)-dione #

Database identifiers

PubChem CID: 600337

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 57.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 291

Related reactions

5 records

New reaction record

HRID 97141As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 478985As reactantuspto-grants-2003_11

HRID 720773As reactantuspto-grants-2006_11

HRID 1069147As reactantuspto-grants-2001_06

HRID 1271452As reactantuspto-grants-2007_04

Compound notes

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