chempirical

N-(Hydroxymethyl)phthalimide

C9H7NO3CAS 118-29-6177.16 g/mol

Open in Covalent MOL file
OONHO
AlcoholAmideLactam

Properties

Molecular formula
C9H7NO3
Molar mass
177.16 g/mol
Exact mass
177.0426 Da
Melting point
141–142 °C
logP
0.23Crippen estimate
Polar surface area
57.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
118-29-6
SMILES
O=C1c2ccccc2C(=O)N1CO
InChIKey
MNSGOOCAMMSKGI-UHFFFAOYSA-N
InChI
InChI=1S/C9H7NO3/c11-5-10-8(12)6-3-1-2-4-7(6)9(10)13/h1-4,11H,5H2

Weigh it out

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

Names and synonyms

12 names
  • 1H-Isoindole-1,3(2H)-dione, 2-(hydroxymethyl)-
  • Phthalimide, N-(hydroxymethyl)-
  • 2-(Hydroxymethyl)-1H-isoindole-1,3(2H)-dione
  • Phthalimidomethyl alcohol
  • (Hydroxymethyl)phthalimide
  • N-Methylolphthalimide
  • NSC 27350
  • NSC 27471
  • NSC 39723
  • 2-(Hydroxymethyl)isoindoline-1,3-dione
  • 2-(Hydroxymethyl)-2,3-dihydro-1H-isoindole-1,3-dione
  • 2-(Hydroxymethyl)isoindole-1,3-dione

Work with N-(Hydroxymethyl)phthalimide

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)phthalimide3891-07-466 % similar 2-(3-Hydroxypropyl)-1H-isoindole-1,3(2H)-dione883-44-361 % similar 2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione17564-64-661 % similar 2-(Phenylmethyl)-1H-isoindole-1,3(2H)-dione2142-01-059 % similar 2-Ethyl-1H-isoindole-1,3(2H)-dione5022-29-759 % similar N-(Bromomethyl)phthalimide5332-26-359 % similar N-Phthaloylglycine4702-13-058 % similar 1,3-Dihydro-1,3-dioxo-2H-isoindole-2-acetaldehyde2913-97-555 % similar

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

Same formula

2,3-Dihydro-1,4-benzodioxin-6-yl isocyanate100275-94-3 5-Carboxyoxindole102359-00-2 N-Methylisatoic anhydride10328-92-4 5-Nitro-2-indanone116530-60-0 2-Nitrocinnamaldehyde1466-88-2 4-Nitrocinnamaldehyde1734-79-8 5-Hydroxyindole-2-carboxylic acid21598-06-1 6-Nitroindanone24623-24-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook