3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride

Name: 3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride
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CAS No. 2170371-90-9
Cat. No. CS-0184210
Purity≥95%
MDL No.None

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Type	HazMat Fee
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride|CS-0184210

Structure of 2170371-90-9

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General Information

CAS No. 2170371-90-9
Cat. No. CS-0184210
Purity ≥95%
MDL No. None
Storage Store at room temperature, keep dry and cool
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₉ClN₂
Molecular Weight 144.60
Synonym(s) None
SMILES N#CC1(C2)CC2(N)C1.[H]Cl

Description

3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride delivers a rigid, electron-rich scaffold with a pendant nitrile group and a protonated amine, enabling direct incorporation into bioactive molecules. This bench-stable salt enhances solubility and handles well under standard conditions.

Application

3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride serves as a rigid, conformationally constrained building block for medicinal chemistry and target-oriented synthesis. The bicyclic scaffold imparts high metabolic stability and reduced flexibility, while the amino and nitrile groups enable diverse downstream functionalization via amide coupling, alkylation, or cyclization. Bench-stable and readily purified, it facilitates efficient access to complex heterocyclic systems and API-relevant scaffolds under standard synthetic conditions.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 49.81
LogP 0.81318
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Bridge Rings compounds Other bridge ring compounds

Building Blocks Skeleton Fatty ring compounds Cyclobutane compounds

Key Words

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3-Aminobicyclo[1.1.1]pentane-1-carbonitrile hydrochloride

CAS No. 2170371-90-9

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