76824-99-2
6-HYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
Name6-HYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
1Identification
【Name】
6-HYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00800582
【English Synonyms】
【Formula】
C10 H11 N O3
【MolWeight】
193.201
【Inchi】
InChI=1S/C10H11NO3/c12-8-2-1-6-5-11-9(10(13)14)4-7(6)3-8/h1-3,9,11-12H,4-5H2,(H,13,14)
【InChIKey】
InChIKey=CRAGDYRHPWTZJL-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1O)CC(NC2)C(=O)O
【MOL File】
6-HYDROXY-1,2,3,4-TE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:-1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
6-HYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID.cml