505-34-0
3-(METHYLSULPHONYL)PROPYLISOTHIOCYANATE
Name
3-(METHYLSULPHONYL)PROPYLISOTHIOCYANATE
Formula
C5 H9 N O2 S2
MolWeight
179.263
1Identification
【Name】
3-(METHYLSULPHONYL)PROPYLISOTHIOCYANATE
【CAS】
【MDL】
MFCD01311719
【English Synonyms】
【Formula】
C5 H9 N O2 S2
【MolWeight】
179.263
【Inchi】
InChI=1S/C5H9NO2S2/c1-10(7,8)4-2-3-6-5-9/h2-4H2,1H3
【InChIKey】
InChIKey=ZSJGCHNCYSHQEU-UHFFFAOYSA-N
【SMILES】
CS(=O)(=O)CCCN=C=S
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(METHYLSULPHONYL)PROPYLISOTHIOCYANATE.cml
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ChromaDex
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Advanced Technology & Industrial Co., Ltd.
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