3-Methylindazole-1-carbonyl chloride
TL;DR: 3-Methylindazole-1-carbonyl chloride (CAS 146941-97-1) is a chemical compound with molecular formula C9H7ClN2O and molecular weight 194.02469 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methylindazole-1-carbonyl chloride
Also Known As: 3-methylindazole-1-carbonyl chloride, 3-methyl-1H-indazole-1-carbonyl chloride, 1H-indazole-1-carbonyl chloride, 3-methyl-
Technical Specifications
| Molecular Formula | C9H7ClN2O |
| Molecular Weight | 194.02469 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.02469 Da |
| Heavy Atoms | 13 |
| Complexity | 222.0 |
| SMILES | CC1=NN(C2=CC=CC=C12)C(=O)Cl |
| InChIKey | XLCYHMZUJNTTSG-UHFFFAOYSA-N |
Chemical Property Profile of 3-Methylindazole-1-carbonyl chloride
Property Insights of 3-Methylindazole-1-carbonyl chloride
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylindazole-1-carbonyl chloride. With a topological polar surface area (TPSA) of 34.9 Ų, 3-Methylindazole-1-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylindazole-1-carbonyl chloride 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
What is the CAS number of 3-Methylindazole-1-carbonyl chloride?
The CAS number of 3-Methylindazole-1-carbonyl chloride is 146941-97-1.
What is the molecular formula of 3-Methylindazole-1-carbonyl chloride?
The molecular formula of 3-Methylindazole-1-carbonyl chloride is C9H7ClN2O.
What is the molecular weight of 3-Methylindazole-1-carbonyl chloride?
The molecular weight of 3-Methylindazole-1-carbonyl chloride is 194.02469 g/mol.
Where can I buy 3-Methylindazole-1-carbonyl chloride?
You can request a quote for 3-Methylindazole-1-carbonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methylindazole-1-carbonyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-Methylindazole-1-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.