N-Butylphthalimide
Properties
- Molecular formula
- C12H13NO2
- Molar mass
- 203.24 g/mol
- Exact mass
- 203.0946 Da
- Melting point
- 34 °C
- Boiling point
- 311.8 °C
- logP
- 2.08Crippen estimate
- Polar surface area
- 37.4 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 3
Identifiers
CAS number
1515-72-6SMILES
CCCCN1C(=O)c2ccccc2C1=OInChIKey
DLKDEVCJRCPTLN-UHFFFAOYSA-NInChI
InChI=1S/C12H13NO2/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(13)15/h4-7H,2-3,8H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 1H-Isoindole-1,3(2H)-dione, 2-butyl-
- Phthalimide, N-butyl-
- 2-Butyl-1H-isoindole-1,3(2H)-dione
- N-n-Butylphthalimide
- NSC 3559
- Levegal EAP 4
- 2-Butylisoindole-1,3-dione
- 2-Butyl-2,3-dihydro-1H-isoindole-1,3-dione
- 2-Butyl-isoindole-1,3-dione
- 2-Butylisoindoline-1,3-dione
Work with N-Butylphthalimide
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2-(4-Bromobutyl)-1H-isoindole-1,3(2H)-dione5394-18-364 % similar
N-(3-Bromopropyl)phthalimide5460-29-764 % similar
2-(3-Hydroxypropyl)-1H-isoindole-1,3(2H)-dione883-44-364 % similar
2-Ethyl-1H-isoindole-1,3(2H)-dione5022-29-761 % similar
4-Phthalimidobutyric acid3130-75-458 % similar
N-(2-Hydroxyethyl)phthalimide3891-07-458 % similar
3-Phthalimidopropionaldehyde2436-29-554 % similar
2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione17564-64-653 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds