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9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene structure
Fine Chemical

9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene

TL;DR: 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene (CAS 125014-28-0) is a chemical compound with molecular formula C20H24BrN and molecular weight 357.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

9,9-diethyl-7,7a,8,10-tetrahydronaphtho[1,2-f]isoindol-9-ium bromide

Also Known As: 9,9-diethyl-7a,8,9,10-tetrahydro-7H-naphtho[1,2-f]isoindol-9-ium bromide, 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene, REGID_for_CID_9550214

CAS Number
125014-28-0
Molecular Formula
C20H24BrN
Molecular Weight
357.10922 g/mol
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Technical Specifications

Molecular FormulaC20H24BrN
Molecular Weight357.10922 g/mol
XLogP1.2697
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds2
Exact Mass357.10922 Da
Heavy Atoms22
Complexity420.0
SMILESCC[N+]1(CC2CC3=C(C=C2C1)C4=CC=CC=C4C=C3)CC.[Br-]
InChIKeyNBJKEJVXJCETQR-UHFFFAOYSA-M

Chemical Property Profile of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene

XLogP
1.2697
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
2
Heavy Atoms
22
Complexity
420.0
Exact Mass
357.10922
Monoisotopic Mass
357.10922
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 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene

The XLogP value of 1.2697 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene. With a topological polar surface area (TPSA) of 0.0 Ų, 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene 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 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene?

The CAS number of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene is 125014-28-0.

What is the molecular formula of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene?

The molecular formula of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene is C20H24BrN.

What is the molecular weight of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene?

The molecular weight of 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene is 357.10922 g/mol.

Where can I buy 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene?

You can request a quote for 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene?

Yes, CoreyChem provides custom synthesis services for 9,9-Diethyl-7a,8,9,10-tetrahydro-7H-9-azonia-cyclopenta[b]phenanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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