Methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate

Catalog Number

ACM51919712

Product Name

Methyl 4-(methylsulfanyl)-3-nitrobenzenecarboxylate

Structure

CAS

51919-71-2

Category

Heterocyclic Organic Compound

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

Molecular Weight

227.24

Molecular Formula

C9H9NO4S

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

MSDS

COA

Spec Sheet