Bis(2-chloroethyl)amine hydrochloride

Name: Bis(2-chloroethyl)amine hydrochloride
Brand: ChemScene
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CAS No. 821-48-7
Cat. No. CS-W020124
Molecule weight178.49
Purity≥95%
MDL No.MFCD00012515

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Bis(2-chloroethyl)amine hydrochloride|CS-W020124

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General Information

CAS No. 821-48-7
Cat. No. CS-W020124
Purity ≥95%
MDL No. MFCD00012515
Storage 4°C, sealed storage, away from moisture
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₄H₁₀Cl₃N
Molecular Weight 178.49
Synonym(s) None
SMILES ClCCNCCCl.Cl

Description

Bis(2-chloroethyl)amine hydrochloride is a bifunctional alkylating agent featuring two reactive chloroethyl groups. This compound facilitates efficient crosslinking of nucleophilic sites in biomolecules, enabling stable covalent conjugation in chemical biology and drug development applications. The hydrochloride salt enhances solubility and handling under standard conditions.

Application

Bis(2-chloroethyl)amine (hydrochloride) serves as a versatile bifunctional electrophile in synthetic organic chemistry, enabling efficient crosslinking and cyclization reactions. Its two reactive chloroethyl groups facilitate rapid formation of nitrogen-containing heterocycles, including aziridines and larger ring systems, under mild conditions. The hydrochloride salt enhances shelf stability and solubility in aqueous/organic media, simplifying handling and purification. This reagent is particularly valuable in the synthesis of constrained scaffolds for medicinal chemistry and polymer science applications.

Synthesis

Route1
- 111-42-2
- ~98%
- In-stock
  
  821-48-7
References
- Huazhong University of Science and Technology; Hangzhou Zhongmei Huadong Pharmaceutical Co., Ltd.; JIANG, Fengchao; ZHOU, Ping; CHEN, Jianguo; WANG, Yue; CAO, Baoshuai; YAN, Jia Patent: EP2682390 A1, 2014 ; Location in patent: Paragraph 0018; 0080 ;

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: 3261
Class : 8	Packing Group : Ⅱ
Hazard Statements : H290-H302-H314
Precautionary Statements : P234-P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P390-P405-P406-P501

Quality Control

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Computational Chemistry Data

TPSA 12.03
LogP 1.4754
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Bioactive Molecules Dye and Bio-assay Reagents

Building Blocks Functional Group Amine

Building Blocks Functional Group Chloride

Building Blocks Skeleton Fatty chain compounds

Key Words

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Bis(2-chloroethyl)amine hydrochloride

CAS No. 821-48-7

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