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7H-Benzo(b)phenanthren-12-one, 3-methoxy- structure
Fine Chemical

7H-Benzo(b)phenanthren-12-one, 3-methoxy-

TL;DR: 7H-Benzo(b)phenanthren-12-one, 3-methoxy- (CAS 111238-09-6) is a chemical compound with molecular formula C19H14O2 and molecular weight 274.09937 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-methoxy-7H-benzo[a]anthracen-12-one

Also Known As: 3-Methoxytetraphen-12(7H)-one, 7H-Benzo(b)phenanthren-12-one, 3-methoxy-, 3-Methoxy-7H-benzo(b)phenanthren-12-one, 3-methoxy-7H-benzo[a]anthracen-12-one

CAS Number
111238-09-6
Molecular Formula
C19H14O2
Molecular Weight
274.09937 g/mol
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Application Areas

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

Biotechnology (2 patents) Pharmaceutical Intermediates (4 patents) Photographic Chemicals (16 patents) Polymer Intermediates (1 patents) Specialty Chemicals (1 patents)

Technical Specifications

Molecular FormulaC19H14O2
Molecular Weight274.09937 g/mol
XLogP4.6
Topological Polar Surface Area (TPSA)26.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass274.09937 Da
Heavy Atoms21
Complexity404.0
SMILESCOC1=CC2=C(C=C1)C3=C(CC4=CC=CC=C4C3=O)C=C2
InChIKeyJQBNBBRKXVRQDT-UHFFFAOYSA-N

Chemical Property Profile of 7H-Benzo(b)phenanthren-12-one, 3-methoxy-

XLogP
4.6
TPSA (Topological Polar Surface Area)
26.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
21
Complexity
404.0
Exact Mass
274.09937
Monoisotopic Mass
274.09937
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 7H-Benzo(b)phenanthren-12-one, 3-methoxy-

The XLogP value of 4.6 indicates that 7H-Benzo(b)phenanthren-12-one, 3-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 7H-Benzo(b)phenanthren-12-one, 3-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7H-Benzo(b)phenanthren-12-one, 3-methoxy- 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 7H-Benzo(b)phenanthren-12-one, 3-methoxy-?

The CAS number of 7H-Benzo(b)phenanthren-12-one, 3-methoxy- is 111238-09-6.

What is the molecular formula of 7H-Benzo(b)phenanthren-12-one, 3-methoxy-?

The molecular formula of 7H-Benzo(b)phenanthren-12-one, 3-methoxy- is C19H14O2.

What is the molecular weight of 7H-Benzo(b)phenanthren-12-one, 3-methoxy-?

The molecular weight of 7H-Benzo(b)phenanthren-12-one, 3-methoxy- is 274.09937 g/mol.

Where can I buy 7H-Benzo(b)phenanthren-12-one, 3-methoxy-?

You can request a quote for 7H-Benzo(b)phenanthren-12-one, 3-methoxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 7H-Benzo(b)phenanthren-12-one, 3-methoxy-?

Yes, CoreyChem provides custom synthesis services for 7H-Benzo(b)phenanthren-12-one, 3-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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