31555-60-9 Purity
98%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C12H15ClN2S.
The molecular weight is 254.78 g/mol.
The IUPAC Name is 1-(1-benzothiophen-4-yl)piperazine hydrochloride.
The InChI is InChI=1S/C12H14N2S.ClH/c1-2-11(14-7-5-13-6-8-14)10-4-9-15-12(10)3-1;/h1-4,9,13H,5-8H2;1H.
The InChIKey is XDUUWPNOUUQXBX-UHFFFAOYSA-N.
The Canonical SMILES is C1CN(CCN1)C2=C3C=CSC3=CC=C2.Cl.
The CAS number is 913614-18-3.
The European Community (EC) Number is 812-454-4.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 3.