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Chlorphenoxamine structure
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Chlorphenoxamine

TL;DR: Chlorphenoxamine (CAS 77-38-3) is a chemical compound with molecular formula C18H22ClNO and molecular weight 303.13898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-(4-chlorophenyl)-1-phenylethoxy]-N,N-dimethylethanamine

Also Known As: Chlorphenoxamine, Contristamine, Clorfenoxamina, Clorfenossamina, Chlorphenoxaminum

CAS Number
77-38-3
Molecular Formula
C18H22ClNO
Molecular Weight
303.13898 g/mol
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Application Areas

Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (9 patents) Analytical Reagents (10 patents) Biotechnology (4 patents) Catalysts (3 patents) Heterocyclic Building Blocks (20 patents)

Technical Specifications

Molecular FormulaC18H22ClNO
Molecular Weight303.13898 g/mol
XLogP4.1
Topological Polar Surface Area (TPSA)12.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass303.13898 Da
Heavy Atoms21
Complexity296.0
Melting Point128
SMILESCC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN(C)C
InChIKeyKKHPNPMTPORSQE-UHFFFAOYSA-N

Product Description

Applications: Chlorphenoxamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Chlorphenoxamine is a pharmaceutical intermediate identified by CAS number 77-38-3 and the molecular formula C18H22ClNO and a molecular weight of 303.14 g/mol. Synonyms include Chlorphenoxamine and Contristamine.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Chlorphenoxamine

XLogP
4.1
TPSA (Topological Polar Surface Area)
12.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
21
Complexity
296.0
Exact Mass
303.13898
Monoisotopic Mass
303.13898
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Chlorphenoxamine

The XLogP value of 4.1 indicates that Chlorphenoxamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Chlorphenoxamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorphenoxamine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Chlorphenoxamine?

The CAS number of Chlorphenoxamine is 77-38-3.

What is the molecular formula of Chlorphenoxamine?

The molecular formula of Chlorphenoxamine is C18H22ClNO.

What is the molecular weight of Chlorphenoxamine?

The molecular weight of Chlorphenoxamine is 303.13898 g/mol.

What are the applications of Chlorphenoxamine?

Chlorphenoxamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Chlorphenoxamine?

You can request a quote for Chlorphenoxamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Chlorphenoxamine?

Yes, CoreyChem provides custom synthesis services for Chlorphenoxamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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