6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one
TL;DR: 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one (CAS 20955-75-3) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-5,7-dihydro-1H-indol-4-one
Also Known As: 6,6-dimethyl-6,7-dihydro-1H-indol-4(5H)-one, 6,6-dimethyl-5,7-dihydro-1H-indol-4-one, 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one, 6,6-dimethyl-4,5,6,7-tetrahydro-1h-indol-4-one, 4H-Indol-4-one, 1,5,6,7-tetrahydro-6,6-dimethyl-
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.1698 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 322.3345 |
Chemical Identifiers
| CAS Number | 20955-75-3 |
|---|---|
| SMILES | CC1(CC2=C(C=CN2)C(=O)C1)C |
Product Overview
6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one (CAS 20955-75-3), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: 6,6-dimethyl-5,7-dihydro-1H-indol-4-one.
Chemical Property Profile of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one
Property Insights of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one
The XLogP value of 2.1698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one. With a topological polar surface area (TPSA) of 32.86 Ų, 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one has 1 hydrogen bond donor(s) and 1 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 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one?
The CAS number of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one is 20955-75-3.
What is the molecular formula of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one?
The molecular formula of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one is C10H13NO.
What is the molecular weight of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one?
The molecular weight of 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one is 163.10 g/mol.
Where can I buy 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one?
You can request a quote for 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.