2-methylpropyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate

CAS: 36769-48-9

Molecular Formula	`C15H21NO4`
Molecular Weight	279.33 g/mol
LogP	1.8
Topological Polar Surface Area	70.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	279.14706
Heavy Atoms	20
Complexity	347.0

Chemical Identifiers

CAS Number	36769-48-9
SMILES	`CC(C)COC(=O)C1C2=C(C=C(C=C2)O)C(CN1C)O`
InChIKey	`LRSDNUVUJLHRAP-UHFFFAOYSA-N`

📖 Product Overview

2-methylpropyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate (CAS: 36769-48-9) is a chemical compound with molecular formula C15H21NO4 and molecular weight 279.33 g/mol. Its IUPAC systematic name is 2-methylpropyl 4,6-dihydroxy-2-methyl-3,4-dihydro-1H-isoquinoline-1-carboxylate. LogP 1.8 Topological Polar Surface Area 70.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 279.14706 Heavy Atoms 20 Complexity 347.0 InChI Key: LRSDNUVUJLHRAP-UHFFFAOYSA-N. SMILES: CC(C)COC(=O)C1C2=C(C=C(C=C2)O)C(CN1C)O.

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