chempirical

N-Acetylphthalimide

C10H7NO3CAS 1971-49-9189.17 g/mol

Open in Covalent MOL file
ONOO
AmideLactam

Properties

Molecular formula
C10H7NO3
Molar mass
189.17 g/mol
Exact mass
189.0426 Da
logP
0.83Crippen estimate
Polar surface area
54.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
1971-49-9
SMILES
CC(=O)N1C(=O)C2=CC=CC=C2C1=O
InChIKey
INZUQGFQRYAKQQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H7NO3/c1-6(12)11-9(13)7-4-2-3-5-8(7)10(11)14/h2-5H,1H3

Weigh it out

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

Work with N-Acetylphthalimide

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

N-Methylphthalimide550-44-754 % similar N-Carbethoxyphthalimide22509-74-649 % similar Phthalimidoacetone3416-57-748 % similar N-Isopropylphthalimide304-17-648 % similar 2-Ethyl-1H-isoindole-1,3(2H)-dione5022-29-748 % similar N-Aminophthalimide1875-48-548 % similar N-Bromophthalimide2439-85-248 % similar N-Chlorophthalimide3481-09-248 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,4-Dihydro-4-oxoquinoline-2-carboxylic acid13593-94-7 1,4-Dihydro-4-oxo-3-quinolinecarboxylic acid13721-01-2 5-Phenylisoxazole-3-carboxylic acid14441-90-8 3-Phenyl-5-isoxazolecarboxylic acid14442-12-7 Indole-3-glyoxylic acid1477-49-2 8-Hydroxyquinoline-2-carboxylic acid1571-30-8 2-Hydroxycinchoninic acid15733-89-8 8-Hydroxyquinoline-7-carboxylic acid19829-79-9

Elsewhere

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