596790-86-2
4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBOXYLIC ACID
Name4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBOXYLIC ACID
1Identification
【Name】
4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD03426210
【English Synonyms】
【Formula】
C12 H15 N O2
【MolWeight】
205.255
【Inchi】
InChI=1S/C12H15NO2/c1-12(2)5-6-13-10-4-3-8(11(14)15)7-9(10)12/h3-4,7,13H,5-6H2,1-2H3,(H,14,15)
【InChIKey】
InChIKey=TZCTXNFOGFCRFV-UHFFFAOYSA-N
【SMILES】
CC1(CCNc2c1cc(cc2)C(=O)O)C
【MOL File】
4,4-DIMETHYL-1,2,3,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBOXYLIC ACID.cml