627098-24-2
(1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETONITRILE HYDROCHLORIDE
Name(1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETONITRILE HYDROCHLORIDE
1Identification
【Name】
(1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETONITRILE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01529685
【English Synonyms】
【Formula】
C11 H12 N2 . Cl H
【MolWeight】
208.691
【Inchi】
InChI=1S/C11H12N2.ClH/c12-7-5-11-10-4-2-1-3-9(10)6-8-13-11;/h1-4,11,13H,5-6,8H2;1H
【InChIKey】
InChIKey=YJQVHFGAEMWCOV-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)CCNC2CC#N.Cl
【MOL File】
(1,2,3,4-TETRAHYDRO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETONITRILE HYDROCHLORIDE.cml