5-Chlorooxindole

C₈H₆ClNOCAS 17630-75-0167.59 g/mol

Open in Covalent MOL file

Amide Aryl halide Lactam

Properties

Molecular formula: C₈H₆ClNO
Molar mass: 167.59 g/mol
Exact mass: 167.0138 Da
Melting point: 192–195 °C
logP: 1.83Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowedAcute toxicity, oral
H317 May cause an allergic skin reactionSensitization, Skin
H361f *** Suspected of damaging fertilityReproductive toxicity
H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 613-172-00-2), via PubChem.

Precautionary statements

P203, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P321, P330, P333+P317, P362+P364, P405, P501

Identifiers

CAS number

17630-75-0

SMILES

O=C1Cc2cc(Cl)ccc2N1

InChIKey

WWJLCYHYLZZXBE-UHFFFAOYSA-N

InChI

InChI=1S/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)

Weigh it out

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

Names and synonyms

9 names

2H-Indol-2-one, 5-chloro-1,3-dihydro-
2-Indolinone, 5-chloro-
Oxindole, 5-chloro-
5-Chloro-1,3-dihydro-2H-indol-2-one
5-Chloro-2-oxoindoline
5-Chloro-2-indolinone
5-Chloro-2-oxindole
5-Chloro-1,3-dihydroindol-2-one
5-Chloroindol-2-one

Work with 5-Chlorooxindole

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

5-Bromo-2-oxindole20870-78-460 % similar 5-Aminooxindole20876-36-260 % similar 5-Hydroxyoxindole3416-18-060 % similar 5-Fluoro-1,3-dihydroindol-2-one56341-41-460 % similar 5,6-Dichloroindolin-2-one71293-59-959 % similar 5-(Chloroacetyl)-1,3-dihydro-2H-indol-2-one65435-04-356 % similar 5-Carboxyoxindole102359-00-255 % similar 7-Chloro-2H-1,4-benzothiazin-3(4H)-one5333-05-155 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Chloro-4-methoxybenzonitrile102151-33-7 5-Chloro-2-methylbenzoxazole19219-99-9 4-Chloro-1,3-dihydro-2H-indol-2-one20870-77-3 3-Chloro-4-methylphenyl isocyanate28479-22-3 2-(4-Chlorophenoxy)acetonitrile3598-13-8 3-Chloro-2-methylphenyl isocyanate40397-90-8 2-Chloro-6-methylphenyl isocyanate40398-01-4 5-Chloro-2-methylphenyl isocyanate40411-27-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook