5-Chloro-m-xylene

Name: 5-Chloro-m-xylene
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CAS No. 556-97-8
Cat. No. CS-0153261
Purity≥97%
MDL No.MFCD00060273

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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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General Information

CAS No. 556-97-8
Cat. No. CS-0153261
Purity ≥97%
MDL No. MFCD00060273
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₉Cl
Molecular Weight 140.61
Synonym(s) 5-Chloro-1,3-xylene
SMILES CC1=CC(=CC(=C1)Cl)C

Description

5-Chloro-m-xylene features a chlorinated substituent at the meta position relative to the methyl groups, enhancing its electron-withdrawing character. This structural configuration supports its use in synthesis where controlled reactivity and steric profile are critical. The compound exhibits robust stability under standard conditions and serves as a valuable intermediate in pharmaceutical and agrochemical development.

Application

5-Chloro-m-xylene serves as a valuable building block in synthetic organic chemistry, enabling efficient access to substituted aromatic scaffolds. Its ortho- and para-directed reactivity supports selective functionalization in electrophilic aromatic substitution, while the chlorine substituent provides a handle for palladium-catalyzed cross-coupling reactions. The compound exhibits excellent bench stability and ease of purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and materials development.

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-P302+P352-P304+P340

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Computational Chemistry Data

TPSA 0
LogP 2.95684
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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5-Chloro-m-xylene

CAS No. 556-97-8

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