Benz(e)indeno(1,2-b)indole, 9-ethyl-
TL;DR: Benz(e)indeno(1,2-b)indole, 9-ethyl- (CAS 63991-52-6) is a chemical compound with molecular formula C21H15N and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-11-azapentacyclo[10.8.0.02,10.04,9.015,20]icosa-1(12),2,4(9),5,7,10,13,15,17,19-decaene
Also Known As: Benz(e)indeno(1,2-b)indole, 9-ethyl-, 9-Ethylbenz[e]indeno[1,2-b]indole, 6'-Ethyl-2,3-1',2'-indeno-4,5-benzoindole, 9-Ethylbenzo[e]indeno[1,2-b]indole, Benz[e]indeno[1,2-b]indole, 9-ethyl-
| Molecular Formula | C21H15N |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.12045 |
| Heavy Atoms | 22 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 63991-52-6 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)C=C3C2=NC4=C3C5=CC=CC=C5C=C4 |
| InChIKey | DTCAHTNWKBPKRS-UHFFFAOYSA-N |
Product Overview
Benz(e)indeno(1,2-b)indole, 9-ethyl- (CAS 63991-52-6), with molecular formula C21H15N and molecular weight 281.12 g/mol. IUPAC: 7-ethyl-11-azapentacyclo[10.8.0.02,10.04,9.015,20]icosa-1(12),2,4(9),5,7,10,13,15,17,19-decaene.
Chemical Property Profile of Benz(e)indeno(1,2-b)indole, 9-ethyl-
Property Insights of Benz(e)indeno(1,2-b)indole, 9-ethyl-
The XLogP value of 5.3 indicates that Benz(e)indeno(1,2-b)indole, 9-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, Benz(e)indeno(1,2-b)indole, 9-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(e)indeno(1,2-b)indole, 9-ethyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benz(e)indeno(1,2-b)indole, 9-ethyl-?
The CAS number of Benz(e)indeno(1,2-b)indole, 9-ethyl- is 63991-52-6.
What is the molecular formula of Benz(e)indeno(1,2-b)indole, 9-ethyl-?
The molecular formula of Benz(e)indeno(1,2-b)indole, 9-ethyl- is C21H15N.
What is the molecular weight of Benz(e)indeno(1,2-b)indole, 9-ethyl-?
The molecular weight of Benz(e)indeno(1,2-b)indole, 9-ethyl- is 281.12 g/mol.
Where can I buy Benz(e)indeno(1,2-b)indole, 9-ethyl-?
You can request a quote for Benz(e)indeno(1,2-b)indole, 9-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(e)indeno(1,2-b)indole, 9-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benz(e)indeno(1,2-b)indole, 9-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.