3-Chloro-N-(p-tolyl)propanamide

Name: 3-Chloro-N-(p-tolyl)propanamide
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CAS No. 19342-88-2
Cat. No. CS-0316373
Molecule weight197.66
Purity≥95%
MDL No.MFCD01355341

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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3-Chloro-N-(p-tolyl)propanamide|CS-0316373

Structure of 19342-88-2

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General Information

CAS No. 19342-88-2
Cat. No. CS-0316373
Purity ≥95%
MDL No. MFCD01355341
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₂ClNO
Molecular Weight 197.66
Synonym(s) 3-chloro-N-(4-methylphenyl)propanamide
SMILES CC1=CC=C(C=C1)NC(=O)CCCl

Description

3-Chloro-N-(p-tolyl)propanamide features a chlorinated aliphatic chain linked to a para-tolyl-substituted amide, combining enhanced lipophilicity with steric bulk. This structural motif enables robust integration into bioactive scaffolds, particularly in kinase inhibitor design and medicinal chemistry lead optimization. The molecule exhibits favorable stability under standard bench conditions and facilitates efficient coupling in multistep synthetic sequences.

Application

3-Chloro-N-(p-tolyl)propanamide serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical intermediates. Its chloro-substituted aliphatic amide functionality offers predictable reactivity in nucleophilic substitution and coupling reactions, with good bench stability and straightforward purification via recrystallization or chromatography.

Synthesis

Route1
- 106-49-0
- 625-36-5
- ~99%
- In-stock
  
  19342-88-2
References
- Guarna; Machetti; Occhiato; Scarpi; Comerci, Alessandra; Danza, Giovanna; Mancina, Rosa; Serio, Mario; Hardy, Kimber Journal of Medicinal Chemistry, 2000 , vol. 43, # 20 p. 3718 - 3735

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 29.1
LogP 2.56242
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Chloro-N-(p-tolyl)propanamide

CAS No. 19342-88-2

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