(Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
TL;DR: (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one (CAS 21413-70-7) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxyimino-8,9-dihydro-7H-benzo[7]annulen-5-one
Also Known As: 6-hydroxyimino-8,9-dihydro-7H-benzo[7]annulen-5-one, (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, 5H-Benzocycloheptene-5,6(7H)-dione, 8,9-dihydro-, 6-oxime
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 2.0358 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 396.02893 |
Chemical Identifiers
| CAS Number | 21413-70-7 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C(=O)C(=NO)C1 |
Product Overview
(Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one (CAS 21413-70-7), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 6-hydroxyimino-8,9-dihydro-7H-benzo[7]annulen-5-one.
Chemical Property Profile of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
Property Insights of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
The XLogP value of 2.0358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one. With a topological polar surface area (TPSA) of 49.66 Ų, (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one has 1 hydrogen bond donor(s) and 3 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 (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The CAS number of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is 21413-70-7.
What is the molecular formula of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The molecular formula of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is C11H11NO2.
What is the molecular weight of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The molecular weight of (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is 189.08 g/mol.
Where can I buy (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
You can request a quote for (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
Yes, KEHONG BIO provides custom synthesis services for (Hydroxyimino)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.