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Chemical structure of Boc-L-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

GA21041

Boc-L-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Also known as (3S)-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Educt in the synthesis of DPP-IV inhibitors

ChemicalCAS78879-20-6MW277.32FormulaC15H19NO4
CAS number
78879-20-6
Molecular weight
277.32
Formula
C15H19NO4
Solubility
Soluble in DMSO
InChIKey
HFPVZPNLMJDJFB-LBPRGKRZSA-N
Catalogue number
GA21041
Brand
GLPBIO
Computed properties PubChem CID 664088 · XLogP 2.3 · TPSA 66.8 Ų · H-bond donors 1
XLogP
2.3
TPSA
66.8 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

SMILES CC(C)(C)OC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)O

Computed descriptors from PubChem (CID 664088), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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