(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate

CAS: 93101-36-1

Molecular Formula	`C20H23NO3`
Molecular Weight	325.4 g/mol
LogP	2.9
Topological Polar Surface Area	49.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	325.1678
Heavy Atoms	24
Complexity	574.0

Chemical Identifiers

CAS Number	93101-36-1
SMILES	`CC(=C)C#CC(C1=CC=CC=C1)(C(=O)OCC2=CCN(CC2)C)O`
InChIKey	`FODUEESCYFGXMP-UHFFFAOYSA-N`

📖 Product Overview

(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate (CAS: 93101-36-1) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.4 g/mol. Its IUPAC systematic name is (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate. LogP 2.9 Topological Polar Surface Area 49.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 325.1678 Heavy Atoms 24 Complexity 574.0 InChI Key: FODUEESCYFGXMP-UHFFFAOYSA-N. SMILES: CC(=C)C#CC(C1=CC=CC=C1)(C(=O)OCC2=CCN(CC2)C)O.

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