BENZYLAMINE, o-BROMO-N-(4-CHLOROBUTYL)-N-ETHYL-, OXALATE

(2-bromophenyl)methyl-(4-chlorobutyl)-ethylazanium;2-hydroxy-2-oxoacetate

CAS: 40616-86-2

Molecular Formula	`C15H21BrClNO4`
Molecular Weight	394.69 g/mol
Topological Polar Surface Area	81.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	393.03424
Heavy Atoms	22
Complexity	255.0

Chemical Identifiers

CAS Number	40616-86-2
SMILES	`CC[NH+](CCCCCl)CC1=CC=CC=C1Br.C(=O)(C(=O)[O-])O`
InChIKey	`IGDNVHRKWXLLCR-UHFFFAOYSA-N`

📖 Product Overview

BENZYLAMINE, o-BROMO-N-(4-CHLOROBUTYL)-N-ETHYL-, OXALATE (CAS: 40616-86-2) is a chemical compound with molecular formula C15H21BrClNO4 and molecular weight 394.69 g/mol. Its IUPAC systematic name is (2-bromophenyl)methyl-(4-chlorobutyl)-ethylazanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 81.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 393.03424 Heavy Atoms 22 Complexity 255.0 InChI Key: IGDNVHRKWXLLCR-UHFFFAOYSA-N. SMILES: CC[NH+](CCCCCl)CC1=CC=CC=C1Br.C(=O)(C(=O)[O-])O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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