(2,4-dimethylphenyl)methyl N-(2-pyrrolidin-1-ium-1-ylethyl)carbamate chloride

CAS: 100836-73-5

Molecular Formula	`C16H25ClN2O2`
Molecular Weight	312.83 g/mol
Topological Polar Surface Area	42.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	312.16046
Heavy Atoms	21
Complexity	303.0

Chemical Identifiers

CAS Number	100836-73-5
SMILES	`CC1=CC(=C(C=C1)COC(=O)NCC[NH+]2CCCC2)C.[Cl-]`
InChIKey	`MJXZRKRAMLDFCT-UHFFFAOYSA-N`

📖 Product Overview

(2,4-dimethylphenyl)methyl N-(2-pyrrolidin-1-ium-1-ylethyl)carbamate chloride (CAS: 100836-73-5) is a chemical compound with molecular formula C16H25ClN2O2 and molecular weight 312.83 g/mol. Its IUPAC systematic name is (2,4-dimethylphenyl)methyl N-(2-pyrrolidin-1-ium-1-ylethyl)carbamate chloride. Topological Polar Surface Area 42.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 312.16046 Heavy Atoms 21 Complexity 303.0 InChI Key: MJXZRKRAMLDFCT-UHFFFAOYSA-N. SMILES: CC1=CC(=C(C=C1)COC(=O)NCC[NH+]2CCCC2)C.[Cl-].

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