141946-05-6
1-THIEN-2-YL-1,4-DIHYDRO-5H-TETRAZOL-5-ONE
Name
1-THIEN-2-YL-1,4-DIHYDRO-5H-TETRAZOL-5-ONE
Formula
C5 H4 N4 O S
MolWeight
168.18
1Identification
【Name】
1-THIEN-2-YL-1,4-DIHYDRO-5H-TETRAZOL-5-ONE
【CAS】
【MDL】
MFCD07345592
【English Synonyms】
【Formula】
C5 H4 N4 O S
【MolWeight】
168.18
【Inchi】
InChI=1S/C5H4N4OS/c10-5-6-7-8-9(5)4-2-1-3-11-4/h1-3H,(H,6,8,10)
【InChIKey】
InChIKey=MECGPFLJSDVABY-UHFFFAOYSA-N
【SMILES】
c1cc(sc1)n2c(=O)[nH]nn2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-THIEN-2-YL-1,4-DIHYDRO-5H-TETRAZOL-5-ONE.cml
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Enamine
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