Compound C21H30ClNO2

(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(4-tert-butylphenyl)prop-2-enoate chloride

CAS: 64048-72-2

Molecular Formula	`C21H30ClNO2`
Molecular Weight	363.9 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	363.1965
Heavy Atoms	25
Complexity	471.0

Chemical Identifiers

CAS Number	64048-72-2
SMILES	`CC(C)(C)C1=CC=C(C=C1)C(=C)C(=O)OC2CC3CCC(C2)[NH+]3C.[Cl-]`
InChIKey	`NNADEMKNXDZEKW-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H30ClNO2 (CAS: 64048-72-2) is a chemical compound with molecular formula C21H30ClNO2 and molecular weight 363.9 g/mol. Its IUPAC systematic name is (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(4-tert-butylphenyl)prop-2-enoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 363.1965 Heavy Atoms 25 Complexity 471.0 InChI Key: NNADEMKNXDZEKW-UHFFFAOYSA-N. SMILES: CC(C)(C)C1=CC=C(C=C1)C(=C)C(=O)OC2CC3CCC(C2)[NH+]3C.[Cl-].

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