4-Chloro-phthalimide

C₈H₄ClNO₂CAS 7147-90-2181.57 g/mol

Open in Covalent MOL file

Amide Aryl halide Lactam

Properties

Molecular formula: C₈H₄ClNO₂
Molar mass: 181.57 g/mol
Exact mass: 180.9931 Da
logP: 1.22Crippen estimate
Polar surface area: 46.2 Å²
H-bond donors / acceptors: 1 / 2
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

7147-90-2

SMILES

C1=CC2=C(C=C1Cl)C(=O)NC2=O

InChIKey

BGJNRQSGJHVURK-UHFFFAOYSA-N

InChI

InChI=1S/C8H4ClNO2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,(H,10,11,12)

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Names and synonyms

1 names

4-Chlorophthalimide

Work with 4-Chloro-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

4-Bromophthalimide6941-75-955 % similar 2,4-Dichlorobenzhydrazide5814-06-251 % similar 2,5-Dichlorobenzhydrazide67487-35-851 % similar 4-Chlorophthalic anhydride118-45-650 % similar 2-Chloroanthraquinone131-09-950 % similar 4-Chlorophthalic acid89-20-350 % similar 2,5-Dichlorobenzoyl chloride2905-61-544 % similar 2,5-Dichlorobenzoic acid50-79-344 % similar

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

Same formula

2-Chloro-4-cyanobenzoic acid117738-77-9 5-Chloroisatin17630-76-1 N-Chlorophthalimide3481-09-2 6-Chloroisatin6341-92-0 4-Chloroisatin6344-05-4 7-Chloroisatin7477-63-6

Elsewhere

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