71095-42-6

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71095-42-6 Structure

Identification	Back Directory
[Name] 5-CHLORO-3-METHYLINDOLE
[CAS] 71095-42-6
[Synonyms] 5-CHLORO-3-METHYLINDOLE 1H-Indole, 5-chloro-3-Methyl-
[Molecular Formula] C9H8ClN
[MDL Number] MFCD04972055
[MOL File] 71095-42-6.mol
[Molecular Weight] 165.62

Chemical Properties	Back Directory
[Melting point ] 112-114 °C
[Boiling point ] 302.6±22.0 °C(Predicted)
[density ] 1.273±0.06 g/cm3(Predicted)
[storage temp. ] Keep in dark place,Sealed in dry,Room Temperature
[form ] solid
[pka] 16.39±0.30(Predicted)
[Appearance] White to yellow Solid
[InChI] 1S/C9H8ClN/c1-6-5-11-9-3-2-7(10)4-8(6)9/h2-5,11H,1H3
[InChIKey] MWEBJGCQVFUVQL-UHFFFAOYSA-N
[SMILES] ClC1=CC2=C(C=C1)NC=C2C

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302-H317
[Precautionary statements ] P280
[WGK Germany ] WGK 3
[HS Code ] 2933998090
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Acute Tox. 4 Oral

Spectrum Detail	Back Directory
[Spectrum Detail] 5-CHLORO-3-METHYLINDOLE(71095-42-6)¹HNMR

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