1,3-(N-Mercaptoethylcarboxamide)benzene

Catalog Number	ACM351994940
CAS	351994-94-0
Structure
Synonyms	BDET; Emeramide; 1-N,3-N-Bis(2-sulfanylethyl)benzene-1,3-dicarboxamide
IUPAC Name	1-N,3-N-bis(2-sulfanylethyl)benzene-1,3-dicarboxamide
Molecular Weight	284.39
Molecular Formula	C12H16N2O2S2
InChI	JUTBAVRYDAKVGQ-UHFFFAOYSA-N
InChI Key	InChI=1S/C12H16N2O2S2/c15-11(13-4-6-17)9-2-1-3-10(8-9)12(16)14-5-7-18/h1-3,8,17-18H,4-7H2,(H,13,15)(H,14,16)
Boiling Point	568.9±45.0 °C(Predicted)
Melting Point	132-135°C
Purity	99%
Density	1.229±0.06 g/cm3(Predicted)
Appearance	White solid
Isomeric SMILES	C1=CC(=CC(=C1)C(=O)NCCS)C(=O)NCCS
Odor	Odorless