200811-67-2
2-CHLORO-6,7,8,9-TETRAHYDRO-7-(PHENYLMETHYL)-5H-PYRIDO[2,3-D]AZEPINE
Name2-CHLORO-6,7,8,9-TETRAHYDRO-7-(PHENYLMETHYL)-5H-PYRIDO[2,3-D]AZEPINE
1Identification
【Name】
2-CHLORO-6,7,8,9-TETRAHYDRO-7-(PHENYLMETHYL)-5H-PYRIDO[2,3-D]AZEPINE
【CAS】
【MDL】
MFCD11044617
【English Synonyms】
【Formula】
C16 H17 Cl N2
【MolWeight】
272.777
【Inchi】
InChI=1S/C16H17ClN2/c17-16-7-6-14-8-10-19(11-9-15(14)18-16)12-13-4-2-1-3-5-13/h1-7H,8-12H2
【InChIKey】
InChIKey=NRFXDPYHBNTJJE-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)CN2CCc3ccc(nc3CC2)Cl
【MOL File】
2-CHLORO-6,7,8,9-TET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-6,7,8,9-TETRAHYDRO-7-(PHENYLMETHYL)-5H-PYRIDO[2,3-D]AZEPINE.cml