[(1S,2R)-2-ethoxycarbonyl-2-(4-methoxyphenyl)cyclopropyl]methyl-dimethylazanium chloride

CAS: 85467-77-2

Molecular Formula	`C16H24ClNO3`
Molecular Weight	313.82 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	313.14447
Heavy Atoms	21
Complexity	337.0

Chemical Identifiers

CAS Number	85467-77-2
SMILES	`CCOC(=O)C1(CC1C[NH+](C)C)C2=CC=C(C=C2)OC.[Cl-]`
InChIKey	`BCEPJLJQGQCNPB-CACIRBSMSA-N`

📖 Product Overview

[(1S,2R)-2-ethoxycarbonyl-2-(4-methoxyphenyl)cyclopropyl]methyl-dimethylazanium chloride (CAS: 85467-77-2) is a chemical compound with molecular formula C16H24ClNO3 and molecular weight 313.82 g/mol. Its IUPAC systematic name is [(1S,2R)-2-ethoxycarbonyl-2-(4-methoxyphenyl)cyclopropyl]methyl-dimethylazanium chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 313.14447 Heavy Atoms 21 Complexity 337.0 InChI Key: BCEPJLJQGQCNPB-CACIRBSMSA-N. SMILES: CCOC(=O)C1(CC1C[NH+](C)C)C2=CC=C(C=C2)OC.[Cl-].

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