106181-28-6
1,2,3,4-TETRAHYDRO-1-ISOQUINOLINE CARBOXYLIC ACID ETHYL ESTER
Name1,2,3,4-TETRAHYDRO-1-ISOQUINOLINE CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
1,2,3,4-TETRAHYDRO-1-ISOQUINOLINE CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD01926226
【English Synonyms】
【Formula】
C12 H15 N O2
【MolWeight】
205.255
【Inchi】
InChI=1S/C12H15NO2/c1-2-15-12(14)11-10-6-4-3-5-9(10)7-8-13-11/h3-6,11,13H,2,7-8H2,1H3
【InChIKey】
InChIKey=OOIVWSXZWFQHQS-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1c2ccccc2CCN1
【MOL File】
1,2,3,4-TETRAHYDRO-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRAHYDRO-1-ISOQUINOLINE CARBOXYLIC ACID ETHYL ESTER.cml