[(1S,2R)-2-ethoxycarbonyl-2-phenylcyclopropyl]methyl-methyl-(2-phenylethyl)azanium chloride

CAS: 85467-54-5

Molecular Formula	`C22H28ClNO2`
Molecular Weight	373.9 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	9
Exact Mass	373.18085
Heavy Atoms	26
Complexity	426.0

Chemical Identifiers

CAS Number	85467-54-5
SMILES	`CCOC(=O)C1(CC1C[NH+](C)CCC2=CC=CC=C2)C3=CC=CC=C3.[Cl-]`
InChIKey	`OVGABYAKJODJRE-LBPAWUGGSA-N`

📖 Product Overview

[(1S,2R)-2-ethoxycarbonyl-2-phenylcyclopropyl]methyl-methyl-(2-phenylethyl)azanium chloride (CAS: 85467-54-5) is a chemical compound with molecular formula C22H28ClNO2 and molecular weight 373.9 g/mol. Its IUPAC systematic name is [(1S,2R)-2-ethoxycarbonyl-2-phenylcyclopropyl]methyl-methyl-(2-phenylethyl)azanium chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 9 Exact Mass 373.18085 Heavy Atoms 26 Complexity 426.0 InChI Key: OVGABYAKJODJRE-LBPAWUGGSA-N. SMILES: CCOC(=O)C1(CC1C[NH+](C)CCC2=CC=CC=C2)C3=CC=CC=C3.[Cl-].

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