chempirical

2-(3-Hydroxypropyl)-1H-isoindole-1,3(2H)-dione

C11H11NO3CAS 883-44-3205.21 g/mol

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OONHO
AlcoholAmideLactam

Properties

Molecular formula
C11H11NO3
Molar mass
205.21 g/mol
Exact mass
205.0739 Da
Melting point
74 °C
logP
0.67Crippen estimate
Polar surface area
57.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
883-44-3
SMILES
O=C1c2ccccc2C(=O)N1CCCO
InChIKey
BSMILTTURCQDGJ-UHFFFAOYSA-N
InChI
InChI=1S/C11H11NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,13H,3,6-7H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • 1H-Isoindole-1,3(2H)-dione, 2-(3-hydroxypropyl)-
  • Phthalimide, N-(3-hydroxypropyl)-
  • N-(3-Hydroxypropyl)phthalimide
  • 2-(3-Hydroxypropyl)isoindole-1,3-dione
  • 3-(Phthalimido)propanol
  • NSC 41174
  • 2-(3-Hydroxypropyl)isoindoline-1,3-dione
  • 3-Phthalimido-1-propanol
  • 3-(1,3-Dioxoisoindolin-2-yl)propanol
  • 2-(3-Hydroxypropyl)-2,3-dihydro-1H-isoindole-1,3-dione

Work with 2-(3-Hydroxypropyl)-1H-isoindole-1,3(2H)-dione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-(2-Hydroxyethyl)phthalimide3891-07-479 % similar N-Butylphthalimide1515-72-664 % similar 2-(4-Bromobutyl)-1H-isoindole-1,3(2H)-dione5394-18-364 % similar N-(3-Bromopropyl)phthalimide5460-29-764 % similar 4-Phthalimidobutyric acid3130-75-463 % similar N-(Hydroxymethyl)phthalimide118-29-661 % similar N-Phthaloyl-β-alanine3339-73-957 % similar 3-Phthalimidopropionaldehyde2436-29-554 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(S)-1-Benzyl-3-hydroxypyrrolidine-2,5-dione101469-91-4 Methyl 4-methoxy-1H-indole-2-carboxylate111258-23-2 Rel-(3R,4S)-3-(acetyloxy)-4-phenyl-2-azetidinone133066-59-8 6,7-Dimethoxy-4-hydroxyquinoline13425-93-9 (2Z)-4-Oxo-4-[(phenylmethyl)amino]-2-butenoic acid15329-69-8 Ethyl 5-aminobenzofuran-2-carboxylate174775-48-5 Indole-3-lactic acid1821-52-9 Ethyl 5-hydroxy-1H-indole-2-carboxylate24985-85-1

Elsewhere

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