132589-63-0
2-ACETYL-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID
Name
2-ACETYL-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID
Formula
C12 H13 N O3
MolWeight
219.239
1Identification
【Name】
2-ACETYL-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD16154981
【English Synonyms】
【Formula】
C12 H13 N O3
【MolWeight】
219.239
【Inchi】
InChI=1S/C12H13NO3/c1-8(14)13-7-6-9-4-2-3-5-10(9)11(13)12(15)16/h2-5,11H,6-7H2,1H3,(H,15,16)
【InChIKey】
InChIKey=GSVIIAQSPJADNX-UHFFFAOYSA-N
【SMILES】
CC(=O)N1CCc2ccccc2C1C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ACETYL-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID.cml
Quick Release
(1-[1-(3,4-DIMETHOXYPHENYL)ETHYL]PYRROLIDIN-3-YL)METHANAMINE
(1-[1-(3-NITROPHENYL)ETHYL]PYRROLIDIN-3-YL)METHANAMINE
[1-(1-BENZOFURAN-2-YLMETHYL)PYRROLIDIN-3-YL]METHANAMINE
(1-[1-(2,5-DIMETHYLPHENYL)ETHYL]PYRROLIDIN-3-YL)METHANAMINE
1-([3-(AMINOMETHYL)PYRROLIDINE-1-CARBONYL]AMINO)CYCLOPENTANE-1-CARBOXYLIC ACID
6-([3-(AMINOMETHYL)PYRROLIDINE-1-CARBONYL]AMINO)HEXANOIC ACID
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