40106-14-7
2-AMINO-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHENE-3-CARBONITRILE
Name2-AMINO-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHENE-3-CARBONITRILE
1Identification
【Name】
2-AMINO-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHENE-3-CARBONITRILE
【CAS】
【MDL】
MFCD00622205
【English Synonyms】
【Formula】
C11 H14 N2 S
【MolWeight】
206.312
【Inchi】
InChI=1S/C11H14N2S/c12-7-9-8-5-3-1-2-4-6-10(8)14-11(9)13/h1-6,13H2
【InChIKey】
InChIKey=FFMNIWGELAUZIJ-UHFFFAOYSA-N
【SMILES】
C1CCCc2c(c(c(s2)N)C#N)CC1
【MOL File】
2-AMINO-4,5,6,7,8,9-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-AMINO-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHENE-3-CARBONITRILE.cml