1-Amino-1-phenylpropan-2-one hydrochloride

Name: 1-Amino-1-phenylpropan-2-one hydrochloride
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CAS No. 3904-16-3
Cat. No. CS-0155154
Molecule weight185.65
Purity≥98%
MDL No.MFCD01934460

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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1-Amino-1-phenylpropan-2-one hydrochloride|CS-0155154

Structure of 3904-16-3

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General Information

CAS No. 3904-16-3
Cat. No. CS-0155154
Purity ≥98%
MDL No. MFCD01934460
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₂ClNO
Molecular Weight 185.65
Synonym(s) 1-Amino-1-phenylacetone hydrochloride
SMILES CC(=O)C(C1=CC=CC=C1)N.Cl

Description

1-Amino-1-phenylpropan-2-one hydrochloride features a benzyl-substituted ketone scaffold with a primary amine functionality, delivering enhanced solubility and stability under standard conditions. This bench-stable derivative enables direct incorporation into synthetic sequences requiring nitrogen-rich intermediates.

Application

1-Amino-1-phenylpropan-2-one hydrochloride serves as a versatile building block in synthetic organic chemistry, enabling efficient access to chiral β-amino carbonyl scaffolds. Its stability under standard bench conditions and compatibility with common functional groups facilitate straightforward incorporation into multistep syntheses. The compound functions as a key intermediate in the construction of heterocyclic frameworks and bioactive molecule precursors through established transformations such as reductive amination and cyclization.

Synthesis

Route1
- 25355-34-4
- ~92%
- In-stock
  
  3904-16-3
References
- Kopczynski, Tomasz; Krzyzanowska, Ewa Polish Journal of Chemistry, 1989 , vol. 63, # 4-12 p. 471 - 482
Route2
- 103-79-7
- ~%
- In-stock
  
  3904-16-3
References
- Lin, Chi-Hui; Yang, Ding-Yah Organic Letters, 2013 , vol. 15, # 11 p. 2802 - 2805

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-H315-H319-H335
Precautionary Statements : P261-P280-P302+P352

Quality Control

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Computational Chemistry Data

TPSA 43.09
LogP 1.6972
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-Amino-1-phenylpropan-2-one hydrochloride

CAS No. 3904-16-3

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