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5-Chloro-2-oxindole

CAT: 0572-TRC-C375030-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C375030-1GSize:1 g
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CAS Number
17630-75-0
Synonyms
2H-Indol-2-one, 5-chloro-1,3-dihydro-; 2-Indolinone, 5-chloro- (8CI); Oxindole, 5-chloro- (6CI); 5-Chloro-1,3-dihydro-2H-indol-2-one; 5-Chloro-1,3-dihydroindol-2-one; 5-Chloro-2-oxindole; 5-Chloro-2-oxoindoline; 5-Chloroindol-2-one; 5-Chlorooxindole
Hazard Statement
No Data Available
Smiles
Clc1ccc2NC(=O)Cc2c1
Molecular Formula
C8 H6 Cl N O
Molecular Weight
167.592
InChI
InChI=1S/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
Additionnal Information
IUPAC name: 5-chloroindolin-2-one
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

5-Chlorooxindole

5-Chlorooxindole has been reported in Curcuma aromatica and Curcuma wenyujin with data available.

CAS Number17630-75-0
PubChem CID152801
IUPAC Name5-chloro-1,3-dihydroindol-2-one
Molecular FormulaC8H6ClNO
Molecular Weight167.59
XLogP1.8
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity183
SMILES
C1C2=C(C=CC(=C2)Cl)NC1=O
InChI
InChI=1S/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
InChIKey
WWJLCYHYLZZXBE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Chlorooxindole
CAS: 17630-75-0
CID: 152801
Formula: C8H6ClNO
MW: 167.59
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight167.59
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass167.0137915
Monoisotopic Mass167.0137915
Topological Polar Surface Area29.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity183
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes