3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-
TL;DR: 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- (CAS 58074-25-2) is a chemical compound with molecular formula C8H11NO and molecular weight 137.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5,6,7-hexahydroindol-3-one
Also Known As: 4,5,6,7-Tetrahydro-1H-indol-3(2H)-one, 1,2,4,5,6,7-hexahydroindol-3-one, 4,5,6,7-Tetrahydroindoxyl, 4,5,6,7-Tetrahydro-3-indolinone, 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-
| Molecular Formula | C8H11NO |
|---|---|
| Molecular Weight | 137.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 137.08406 |
| Heavy Atoms | 10 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 58074-25-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=O)CN2 |
| InChIKey | RQVZYMLDSHKDPM-UHFFFAOYSA-N |
Product Overview
3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- (CAS 58074-25-2), with molecular formula C8H11NO and molecular weight 137.08 g/mol. IUPAC: 1,2,4,5,6,7-hexahydroindol-3-one.
Chemical Property Profile of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-
Property Insights of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-. With a topological polar surface area (TPSA) of 29.1 Ų, 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- 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 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-?
The CAS number of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- is 58074-25-2.
What is the molecular formula of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-?
The molecular formula of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- is C8H11NO.
What is the molecular weight of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-?
The molecular weight of 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- is 137.08 g/mol.
Where can I buy 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-?
You can request a quote for 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indol-3-one, 1,2,4,5,6,7-hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.