N-(Allyloxycarbonyloxy)succinimide

C₈H₉NO₅CAS 135544-68-2199.16 g/mol

Open in Covalent MOL file

Alkene Amide Carbonate Lactam

Properties

Molecular formula: C₈H₉NO₅
Molar mass: 199.16 g/mol
Exact mass: 199.0481 Da
logP: 0.39Crippen estimate
Polar surface area: 72.9 Å²
H-bond donors / acceptors: 0 / 5
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed97.5% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.5% of notifiers

Aggregated from 40 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

135544-68-2

SMILES

C=CCOC(=O)ON1C(=O)CCC1=O

InChIKey

OIXALTPBNZNFLJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H9NO5/c1-2-5-13-8(12)14-9-6(10)3-4-7(9)11/h2H,1,3-5H2

Weigh it out

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

Work with N-(Allyloxycarbonyloxy)succinimide

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

Di(succinimido) carbonate74124-79-159 % similar Diallyl dicarbonate115491-93-559 % similar Methyl 2-propen-1-yl carbonate35466-83-253 % similar Diallyl diglycol carbonate142-22-352 % similar N-(2,2,2-Trichloroethoxycarbonyloxy)succinimide66065-85-851 % similar 2,5-Dioxo-1-pyrrolidinyl [2-(trimethylsilyl)ethyl] carbonate78269-85-949 % similar N-Succinimidyl acrylate38862-24-748 % similar N-(Benzyloxycarbonyloxy)succinimide13139-17-847 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Clavulanic acid58001-44-8

Elsewhere

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