N-(3-Bromopropyl)phthalimide

C11H10BrNO2CAS 5460-29-7268.11 g/mol

Open in Covalent MOL file
OONBr
Alkyl halideAmideLactam

Properties

Molecular formula
C11H10BrNO2
Molar mass
268.11 g/mol
Exact mass
266.9895 Da
Melting point
74–76 °C
logP
2.07Crippen estimate
Polar surface area
37.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
5460-29-7
SMILES
O=C1c2ccccc2C(=O)N1CCCBr
InChIKey
VKJCJJYNVIYVQR-UHFFFAOYSA-N
InChI
InChI=1S/C11H10BrNO2/c12-6-3-7-13-10(14)8-4-1-2-5-9(8)11(13)15/h1-2,4-5H,3,6-7H2

Weigh it out

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

Names and synonyms

16 names · show all
  • 1H-Isoindole-1,3(2H)-dione, 2-(3-bromopropyl)-
  • Phthalimide, N-(3-bromopropyl)-
  • 2-(3-Bromopropyl)-1H-isoindole-1,3(2H)-dione
  • (γ-Bromopropyl)phthalimide
  • (3-Bromopropyl)phthalimide
  • 1-Phthalimido-3-bromopropane
  • 3-Bromo-N-phthaloylpropylamine
  • 2-(3-Bromopropyl)isoindole-1,3-dione
  • NSC 24937
  • NSC 25170
  • 2-(3-Bromopropyl)isoindoline-1,3-dione
  • 3-(Phthalimido)propyl bromide
  • 2-(3-Bromopropyl)-1H-isoindol-1,3(2H)-dione
  • 2-(3-Bromopropyl)-2,3-dihydro-1H-isoindol-1,3-dione
  • 2-(3-Bromopropyl)-2,3-dihydro-1H-isoindole-1,3-dione
  • N-3-Bromopropylphthalimide

Work with N-(3-Bromopropyl)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

2-(4-Bromobutyl)-1H-isoindole-1,3(2H)-dione5394-18-393 % similar N-(6-Bromohexyl)phthalimide24566-79-890 % similar N-(10-Bromodec-1-yl)phthalimide24566-80-190 % similar N-(5-Bromopentyl)phthalimide954-81-490 % similar N-(2-Bromoethyl)phthalimide574-98-179 % similar N-(Bromomethyl)phthalimide5332-26-367 % similar N-Butylphthalimide1515-72-664 % similar 2-(3-Hydroxypropyl)-1H-isoindole-1,3(2H)-dione883-44-364 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromoindole-2-carboxylic acid ethyl ester103858-52-2 Ethyl 6-bromoindole-2-carboxylate103858-53-3 2-(Ethoxycarbonyl)-5-bromo-indole16732-70-0 Ethyl 3-bromoindole-2-carboxylate91348-45-7

Elsewhere

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