52559-43-0
N-(2-HYDROXYETHYL)BENZO[K,L]THIOXANTHENE-3,4-DICARBOXIMIDE
NameN-(2-HYDROXYETHYL)BENZO[K,L]THIOXANTHENE-3,4-DICARBOXIMIDE
1Identification
【Name】
N-(2-HYDROXYETHYL)BENZO[K,L]THIOXANTHENE-3,4-DICARBOXIMIDE
【CAS】
【MDL】
MFCD00376727
【English Synonyms】
【Formula】
C20 H13 N O3 S
【MolWeight】
347.393
【Inchi】
InChI=1S/C20H13NO3S/c22-10-9-21-19(23)13-6-5-12-11-3-1-2-4-15(11)25-16-8-7-14(20(21)24)17(13)18(12)16/h1-8,22H,9-10H2
【InChIKey】
InChIKey=NMTZRXOITBLOMT-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)c3ccc4c5c3c(s2)ccc5c(=O)n(c4=O)CCO
【MOL File】
N-(2-HYDROXYETHYL)BE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-HYDROXYETHYL)BENZO[K,L]THIOXANTHENE-3,4-DICARBOXIMIDE.cml