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Structure

Methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate

CAS
51919-71-2
Catalog Number
ACM51919712
Category
Other Products
Molecular Weight
227.24
Molecular Formula
C9H9NO4S

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Specification

Synonyms
51919-71-2, methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate, SureCN7357430, CTK4J5117, MolPort-009-195-765, methyl 4-methylthio-3-nitrobenzoate, SBB097143, ZINC14007565, AKOS005072102, AG-F-76434, CC-0712, MCULE-4144566821, RP13095, methylmethylsulfanylnitrobenzenecarboxylate, methyl 4-(methylsulfanyl)-3-nitrobenzoate, KB-256808, FT-0680895, I01-14671
IUPAC Name
methyl 4-methylsulfanyl-3-nitrobenzoate
Canonical SMILES
COC(=O)C1=CC(=C(C=C1)SC)[N+](=O)[O-]
InChI Key
MLFKUEQFNLAOQT-UHFFFAOYSA-N
Boiling Point
352.4ºC at 760 mmHg
Melting Point
102-103ºC
Flash Point
166.9ºC
Density
1.35g/cm³
Exact Mass
227.02500
H-Bond Acceptor
5
H-Bond Donor
0
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