1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-
TL;DR: 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- (CAS 54789-38-7) is a chemical compound with molecular formula C10H8N2O and molecular weight 172.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diazo-3-methyl-3H-inden-1-one
Also Known As: 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-, 2-diazonio-3-methyl-3H-inden-1-olate, 2-Diazo-2,3-dihydro-3-methyl-1H-inden-1-one, 2-diazo-3-methyl-2,3-dihydro-1H-inden-1-one, 3-methyl-2-(lambda5-diazynylidene)-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C10H8N2O |
|---|---|
| Molecular Weight | 172.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 19.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.06366 |
| Heavy Atoms | 13 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 54789-38-7 |
|---|---|
| SMILES | CC1C2=CC=CC=C2C(=O)C1=[N+]=[N-] |
| InChIKey | GVKVXKJOIDUROP-UHFFFAOYSA-N |
Product Overview
1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- (CAS 54789-38-7), with molecular formula C10H8N2O and molecular weight 172.06 g/mol. IUPAC: 2-diazo-3-methyl-3H-inden-1-one.
Chemical Property Profile of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-
Property Insights of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-. With a topological polar surface area (TPSA) of 19.1 Ų, 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- has 0 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 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-?
The CAS number of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- is 54789-38-7.
What is the molecular formula of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-?
The molecular formula of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- is C10H8N2O.
What is the molecular weight of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-?
The molecular weight of 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- is 172.06 g/mol.
Where can I buy 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-?
You can request a quote for 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.