885460-08-2
4-(2-CHLOROPHENYL)-1-METHYL-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE
Name4-(2-CHLOROPHENYL)-1-METHYL-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE
1Identification
【Name】
4-(2-CHLOROPHENYL)-1-METHYL-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE
【CAS】
【MDL】
MFCD04621648
【English Synonyms】
【Formula】
C18 H17 Cl N2
【MolWeight】
296.799
【Inchi】
InChI=1S/C18H17ClN2/c1-11-18-17(13-7-3-5-9-16(13)21-18)14(10-20-11)12-6-2-4-8-15(12)19/h2-9,11,14,20-21H,10H2,1H3
【InChIKey】
InChIKey=XLHRCDUFNATZLY-UHFFFAOYSA-N
【SMILES】
CC1c2c(c3ccccc3[nH]2)C(CN1)c4ccccc4Cl
【MOL File】
4-(2-CHLOROPHENYL)-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-CHLOROPHENYL)-1-METHYL-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE.cml