[1-(dimethylamino)-2-[(dimethylamino)methyl]-4-phenylbutan-2-yl] 4-butoxybenzoate

CAS: 78329-82-5

Molecular Formula	`C26H38N2O3`
Molecular Weight	426.6 g/mol
LogP	5.3
Topological Polar Surface Area	42.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	14
Exact Mass	426.28824
Heavy Atoms	31
Complexity	485.0

Chemical Identifiers

CAS Number	78329-82-5
SMILES	`CCCCOC1=CC=C(C=C1)C(=O)OC(CCC2=CC=CC=C2)(CN(C)C)CN(C)C`
InChIKey	`FTPBXVAJKGEDJB-UHFFFAOYSA-N`

📖 Product Overview

[1-(dimethylamino)-2-[(dimethylamino)methyl]-4-phenylbutan-2-yl] 4-butoxybenzoate (CAS: 78329-82-5) is a chemical compound with molecular formula C26H38N2O3 and molecular weight 426.6 g/mol. Its IUPAC systematic name is [1-(dimethylamino)-2-[(dimethylamino)methyl]-4-phenylbutan-2-yl] 4-butoxybenzoate. LogP 5.3 Topological Polar Surface Area 42.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 14 Exact Mass 426.28824 Heavy Atoms 31 Complexity 485.0 InChI Key: FTPBXVAJKGEDJB-UHFFFAOYSA-N. SMILES: CCCCOC1=CC=C(C=C1)C(=O)OC(CCC2=CC=CC=C2)(CN(C)C)CN(C)C.

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