362492-00-0
2-BOC-6-HYDROXY-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLIC ACID
Name2-BOC-6-HYDROXY-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLIC ACID
1Identification
【Name】
2-BOC-6-HYDROXY-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD04114847
【English Synonyms】
【Formula】
C15 H19 N O5
【MolWeight】
293.317
【Inchi】
InChI=1S/C15H19NO5/c1-15(2,3)21-14(20)16-7-6-9-8-10(17)4-5-11(9)12(16)13(18)19/h4-5,8,12,17H,6-7H2,1-3H3,(H,18,19)
【InChIKey】
InChIKey=KCDBTPOYUDNXBR-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCc2cc(ccc2C1C(=O)O)O
【MOL File】
2-BOC-6-HYDROXY-1,2,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-BOC-6-HYDROXY-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLIC ACID.cml