3-Aminophthalimide

C8H6N2O2CAS 2518-24-3162.15 g/mol

Open in Covalent MOL file
H2NONHO
Primary amine

Properties

Molecular formula
C8H6N2O2
Molar mass
162.15 g/mol
Exact mass
162.0429 Da
Melting point
268–269 °C
logP
0.73Crippen estimate
Polar surface area
75.7 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2518-24-3
SMILES
Nc1cccc2c1C(=O)N=C2O
InChIKey
GQBONCZDJQXPLV-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O2/c9-5-3-1-2-4-6(5)8(12)10-7(4)11/h1-3H,9H2,(H,10,11,12)

Weigh it out

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

Names and synonyms

5 names
  • 1H-Isoindole-1,3(2H)-dione, 4-amino-
  • Phthalimide, 3-amino-
  • 4-Amino-1H-isoindole-1,3(2H)-dione
  • 4-Amino-1,3-dioxo-2,3-dihydro-1H-isoindole
  • 4-Aminoisoindoline-1,3-dione

Work with 3-Aminophthalimide

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

Phthalimide85-41-655 % similar 3-Nitrophthalimide603-62-354 % similar 3-Aminophthalic acid5434-20-853 % similar N-(5-Amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)benzamide117-06-652 % similar Naphthalimide81-83-451 % similar 1,5-Diaminoanthraquinone129-44-250 % similar 3-Aminophthalic acid hydrochloride6946-22-149 % similar 2,3-Diaminobenzoic acid603-81-649 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Pyrazolo[1,5-A]pyridine-5-carboxylic acid104468-87-3 3-(5-Azaindole)carboxylic acid119248-43-0 N-Phenylsydnone120-06-9 Imidazo[1,2-A]pyridine-8-carboxylic acid133427-08-4 1H-Pyrrolo[2,3-B]pyridine-2-carboxylic acid136818-50-3 Imidazo(1,2-a)pyridine-6-carboxylic acid139022-25-6 2,3-Dihydro-1,4-phthalazinedione1445-69-8 1H-Pyrrolo(2,3-b)pyridine-3-carboxylic acid156270-06-3

Elsewhere

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