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Naphthgeranine A structure
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Naphthgeranine A

TL;DR: Naphthgeranine A (CAS 137109-43-4) is a chemical compound with molecular formula C22H24O5 and molecular weight 368.16238 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(4aS,12bR)-8,10-dimethoxy-2,5,5-trimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione

Also Known As: Naphthgeranine A, 7-Demethylnaphterpin, J1.463.116J, (4aS,12bR)-8,10-dimethoxy-2,5,5-trimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione, 4H-Benzo(d)naphtho(2,3-b)pyran-7,12-dione, 3,4a,5,12b-tetrahydro-8,10-dimethoxy-2,5,5-trimethyl-, (4aS-cis)-

CAS Number
137109-43-4
Molecular Formula
C22H24O5
Molecular Weight
368.16238 g/mol
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Technical Specifications

Molecular FormulaC22H24O5
Molecular Weight368.16238 g/mol
XLogP3.4
Topological Polar Surface Area (TPSA)61.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass368.16238 Da
Heavy Atoms27
Complexity731.0
SMILESCC1=C[C@@H]2[C@H](CC1)C(OC3=C2C(=O)C4=C(C3=O)C(=CC(=C4)OC)OC)(C)C
InChIKeyUXJQIMIAQWIAOG-HIFRSBDPSA-N

Chemical Property Profile of Naphthgeranine A

XLogP
3.4
TPSA (Topological Polar Surface Area)
61.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
27
Complexity
731.0
Exact Mass
368.16238
Monoisotopic Mass
368.16238
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 Naphthgeranine A

The XLogP value of 3.4 indicates that Naphthgeranine A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthgeranine A. Following Lipinski's Rule of Five, Naphthgeranine A has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Naphthgeranine A?

The CAS number of Naphthgeranine A is 137109-43-4.

What is the molecular formula of Naphthgeranine A?

The molecular formula of Naphthgeranine A is C22H24O5.

What is the molecular weight of Naphthgeranine A?

The molecular weight of Naphthgeranine A is 368.16238 g/mol.

Where can I buy Naphthgeranine A?

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

Does CoreyChem offer custom synthesis for Naphthgeranine A?

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

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