3-Chloro-5-fluorobenzene-1,2-diamine

Name: 3-Chloro-5-fluorobenzene-1,2-diamine
Brand: ChemScene
Availability: InStock
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CAS No. 153505-33-0
Cat. No. CS-0060184
Purity≥97%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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3-Chloro-5-fluorobenzene-1,2-diamine|CS-0060184

Structure of 153505-33-0

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General Information

CAS No. 153505-33-0
Cat. No. CS-0060184
Purity ≥97%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₆ClFN₂
Molecular Weight 160.58
Synonym(s) 3-Chloro-5-fluoro-1,2-benzenediamine
SMILES C1=C(C=C(C(=C1Cl)N)N)F

Description

3-Chloro-5-fluorobenzene-1,2-diamine features a dual-heteroatom substitution pattern on a benzene ring, delivering enhanced reactivity for coupling reactions. The ortho-diamine motif enables efficient coordination in metal complexation, while the electron-withdrawing chlorine and fluorine substituents modulate electronic properties for tailored synthesis applications.

Application

3-Chloro-5-fluorobenzene-1,2-diamine serves as a versatile building block in medicinal chemistry, enabling the synthesis of heterocyclic scaffolds through standard coupling and cyclization protocols. Its ortho-diamine functionality facilitates efficient coordination in transition metal-catalyzed reactions, while the chloro and fluoro substituents offer complementary reactivity for late-stage functionalization. Bench-stable and compatible with common purification methods, it functions effectively in multi-step syntheses targeting bioactive molecules.

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-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 52.04
LogP 1.6435
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Chloride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Chloro-5-fluorobenzene-1,2-diamine

CAS No. 153505-33-0

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