5H-Dibenzo(a,d)cyclohepten-5-one oxime
TL;DR: 5H-Dibenzo(a,d)cyclohepten-5-one oxime (CAS 1021-91-6) is a chemical compound with molecular formula C15H11NO and molecular weight 221.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)hydroxylamine
Also Known As: 5H-Dibenzo[a,d][7]annulen-5-one oxime, 5H-Dibenzo[a,d]cyclohepten-5-one oxime, dibenzosuberenone oxime, 5H-Dibenzo[a, oxime, 5H-Dibenzo[a,d]cyclohepten-5-one, oxime
| Molecular Formula | C15H11NO |
|---|---|
| Molecular Weight | 221.08 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 221.08406 |
| Heavy Atoms | 17 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 1021-91-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC=CC=C3C2=NO |
| InChIKey | LRBLEEPNJOPXOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5H-Dibenzo(a,d)cyclohepten-5-one oxime (CAS 1021-91-6), with molecular formula C15H11NO and molecular weight 221.08 g/mol. IUPAC: N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)hydroxylamine.
Chemical Property Profile of 5H-Dibenzo(a,d)cyclohepten-5-one oxime
Property Insights of 5H-Dibenzo(a,d)cyclohepten-5-one oxime
The XLogP value of 4.1 indicates that 5H-Dibenzo(a,d)cyclohepten-5-one oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.6 Ų, 5H-Dibenzo(a,d)cyclohepten-5-one oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(a,d)cyclohepten-5-one oxime has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5H-Dibenzo(a,d)cyclohepten-5-one oxime?
The CAS number of 5H-Dibenzo(a,d)cyclohepten-5-one oxime is 1021-91-6.
What is the molecular formula of 5H-Dibenzo(a,d)cyclohepten-5-one oxime?
The molecular formula of 5H-Dibenzo(a,d)cyclohepten-5-one oxime is C15H11NO.
What is the molecular weight of 5H-Dibenzo(a,d)cyclohepten-5-one oxime?
The molecular weight of 5H-Dibenzo(a,d)cyclohepten-5-one oxime is 221.08 g/mol.
Where can I buy 5H-Dibenzo(a,d)cyclohepten-5-one oxime?
You can request a quote for 5H-Dibenzo(a,d)cyclohepten-5-one oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenzo(a,d)cyclohepten-5-one oxime?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(a,d)cyclohepten-5-one oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.