582321-06-0
3-(METHYLSULFONYL)-1H-INDOLE
Name
3-(METHYLSULFONYL)-1H-INDOLE
Formula
C9 H9 N O2 S
MolWeight
195.241
1Identification
【Name】
3-(METHYLSULFONYL)-1H-INDOLE
【CAS】
【MDL】
MFCD20688113
【English Synonyms】
【Formula】
C9 H9 N O2 S
【MolWeight】
195.241
【Inchi】
InChI=1S/C9H9NO2S/c1-13(11,12)9-6-10-8-5-3-2-4-7(8)9/h2-6,10H,1H3
【InChIKey】
InChIKey=LURCQPDCRKARFF-UHFFFAOYSA-N
【SMILES】
CS(=O)(=O)c1c[nH]c2c1cccc2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(METHYLSULFONYL)-1H-INDOLE.cml
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