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Phenanthridine structure
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Phenanthridine

TL;DR: Phenanthridine (CAS 229-87-8) is a chemical compound with molecular formula C13H9N and molecular weight 179.0735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

phenanthridine

Also Known As: PHENANTHRIDINE, Benzo[c]quinoline, 6-Phenanthridine, 9-Azaphenanthrene, 3,4-Benzoquinoline

CAS Number
229-87-8
Molecular Formula
C13H9N
Molecular Weight
179.0735 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (256 patents) Analytical Reagents (1515 patents) Biotechnology (2755 patents) Catalysts (99 patents) Coatings & Adhesives (48 patents)

Technical Specifications

Molecular FormulaC13H9N
Molecular Weight179.0735 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)12.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass179.0735 Da
Heavy Atoms14
Complexity201.0
Melting Point223 to 225 °F (NTP, 1992)
Boiling Point660 °F at 760 mmHg (NTP, 1992)
Vapor Pressure0.0000208 [mmHg]
Solubility7.7 [ug/mL] (The mean of the results at pH 7.4)
SMILESC1=CC=C2C(=C1)C=NC3=CC=CC=C23
InChIKeyRDOWQLZANAYVLL-UHFFFAOYSA-N

Product Description

Applications: Phenanthridine 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. CoreyChem supplies Phenanthridine (CAS 229-87-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Phenanthridine (CAS 229-87-8) is a pharmaceutical intermediate with the molecular formula C13H9N and a molecular weight of 179.07 g/mol. Key physical properties include a solubility: 7.7 [ug/mL] (The mean of the results at pH 7.4). It is also known as PHENANTHRIDINE and Benzo[c]quinoline.

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 Phenanthridine

XLogP
3.5
TPSA (Topological Polar Surface Area)
12.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
14
Complexity
201.0
Exact Mass
179.0735
Monoisotopic Mass
179.0735
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 Phenanthridine

The XLogP value of 3.5 indicates that Phenanthridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, Phenanthridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenanthridine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Phenanthridine?

The CAS number of Phenanthridine is 229-87-8.

What is the molecular formula of Phenanthridine?

The molecular formula of Phenanthridine is C13H9N.

What is the molecular weight of Phenanthridine?

The molecular weight of Phenanthridine is 179.0735 g/mol.

What are the applications of Phenanthridine?

Phenanthridine 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. CoreyChem supplies Phenanthridine (CAS 229-87-8) with...

Where can I buy Phenanthridine?

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

Does CoreyChem offer custom synthesis for Phenanthridine?

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

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