ChemicalBook--->CAS DataBase List--->89976-15-8

89976-15-8

89976-15-8 Structure

89976-15-8 Structure
IdentificationBack Directory
[Name]

7-Iodoindole
[CAS]

89976-15-8
[Synonyms]

7-Iodoindole
7-iodo-1H-indole
1H-Indole,7-iodo-
[Molecular Formula]

C8H6IN
[MDL Number]

MFCD10000889
[MOL File]

89976-15-8.mol
[Molecular Weight]

243.04
Chemical PropertiesBack Directory
[Melting point ]

52-56 °C
[Boiling point ]

341.7±15.0 °C(Predicted)
[density ]

1.960±0.06 g/cm3(Predicted)
[Fp ]

110 °C
[storage temp. ]

2-8°C(protect from light)
[form ]

solid
[pka]

15.50±0.30(Predicted)
[Appearance]

Light yellow to yellow Solid
[InChI]

1S/C8H6IN/c9-7-3-1-2-6-4-5-10-8(6)7/h1-5,10H
[InChIKey]

VBKAPLYISDSUCE-UHFFFAOYSA-N
[SMILES]

Ic1cccc2cc[nH]c12
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-41
[Safety Statements ]

26
[RIDADR ]

UN 3335
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Spectrum DetailBack Directory
[Spectrum Detail]

7-Iodoindole(89976-15-8)1HNMR
Hazard InformationBack Directory
[Purification Methods]

Purify 7-iodoindole by chromatography through a silica gel column and eluting with CH2Cl2/hexane (1:3, v/v) followed by recrystallisation from hexane (colourless plates, m 55-56o). [Somei et al. Chem Pharm Bull Jpn 35 3146 1987, Somei & Saida Heterocycles 23 3114 1985.]
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