(S)-(+)-N-(2,3-Epoxypropyl)phthalimide

C₁₁H₉NO₃CAS 161596-47-0203.20 g/mol

Open in Covalent MOL file

Amide Epoxide Ether Lactam

Properties

Molecular formula: C₁₁H₉NO₃
Molar mass: 203.20 g/mol
Exact mass: 203.0582 Da
logP: 0.68Crippen estimate
Polar surface area: 49.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Hazards

Danger

H317 May cause an allergic skin reaction46.1% of notifiers
H318 Causes serious eye damage99.3% of notifiers
H341 Suspected of causing genetic defects47.4% of notifiers

Aggregated from 152 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264+P265, P272, P280, P302+P352, P305+P354+P338, P317, P318, P321, P333+P317, P362+P364, P405, P501

Identifiers

CAS number

161596-47-0

SMILES

O=C1c2ccccc2C(=O)N1C[C@H]1CO1

InChIKey

DUILGEYLVHGSEE-ZETCQYMHSA-N

InChI

InChI=1S/C11H9NO3/c13-10-8-3-1-2-4-9(8)11(14)12(10)5-7-6-15-7/h1-4,7H,5-6H2/t7-/m0/s1

Weigh it out

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

Names and synonyms

18 names · show all

2-[(2S)-2-Oxiranylmethyl]-1H-isoindole-1,3(2H)-dione
1H-Isoindole-1,3(2H)-dione, 2-[(2S)-2-oxiranylmethyl]-
1H-Isoindole-1,3(2H)-dione, 2-(oxiranylmethyl)-, (S)-
1H-Isoindole-1,3(2H)-dione, 2-[(2S)-oxiranylmethyl]-
N-((2S)-Oxiran-2-ylmethyl)phthalimide
2-[(S)-2-Oxiranylmethyl]-1H-isoindol-1,3(2H)-dione
N-(S)-Glycidylphthalimide
(S)-N-(2,3-Epoxypropan-1-yl)phthalimide
(S)-2-[(Oxiranyl)methyl]isoindole-1,3-dione
(S)-N-(2,3-Epoxypropyl)phthalimide
(S)-2-(Oxiran-2-ylmethyl)-1H-isoindole-1,3(2H)-dione
N-[(+)-Glycidyl]phthalimide
N-[(S)-(+)-Glycidyl]phthalimide
(S)-Glycidyl phthalimide
(S)-N-Giycidylphthalimide
(S)-2-(Oxiran-2-ylmethyl)isoindoline-1,3-dione
(S)-N-Glycidylphthalimide
2-[[(2S)-Oxiran-2-yl]methyl]isoindole-1,3-dione

Work with (S)-(+)-N-(2,3-Epoxypropyl)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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

N-(2,3-Epoxypropyl)phthalimide5455-98-1Stereo not defined

Similar compounds

Phthalimidoacetaldehyde diethyl acetal78902-09-761 % similar 2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione17564-64-652 % similar 1,3-Dihydro-1,3-dioxo-2H-isoindole-2-acetaldehyde2913-97-551 % similar N-(Hydroxymethyl)phthalimide118-29-650 % similar Benzylphthalimide2142-01-050 % similar 2-Ethyl-1H-isoindole-1,3(2H)-dione5022-29-750 % similar N-(Bromomethyl)phthalimide5332-26-350 % similar N-Butylphthalimide1515-72-649 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Methyl-3-phenylisoxazole-4-carboxylic acid1136-45-4 3-Hydroxy-2-methyl-4-quinolinecarboxylic acid117-57-7 Methyl 3-formyl-1H-indole-6-carboxylate133831-28-4 3-Formyl-1H-indole-1-acetic acid138423-98-0 4-Methoxy-2-quinolinecarboxylic acid15733-83-2 N-(2-Methoxyphenyl)maleimide17392-68-6 Methyl indolyl-3-glyoxylate18372-22-0 3-Formyl-1H-indole-5-carboxylic acid methyl ester197506-83-5

Elsewhere

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