2-Nitro-5-(trichloromethylsulfonylmethyl)furan
TL;DR: 2-Nitro-5-(trichloromethylsulfonylmethyl)furan (CAS 68095-64-7) is a chemical compound with molecular formula C6H4Cl3NO5S and molecular weight 306.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-5-(trichloromethylsulfonylmethyl)furan
Also Known As: 2-nitro-5-(trichloromethylsulfonylmethyl)furan, (5-nitro-2-furyl)methyl trichloromethyl sulfone, 2-Nitro-5-[(trichloromethanesulfonyl)methyl]furan, 2-NITRO-5-(TRICHLOROMETHANESULFONYLMETHYL)FURAN
| Molecular Formula | C6H4Cl3NO5S |
|---|---|
| Molecular Weight | 306.89 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.88757 |
| Heavy Atoms | 16 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 68095-64-7 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])CS(=O)(=O)C(Cl)(Cl)Cl |
| InChIKey | BRSQSHDRNJRRAV-UHFFFAOYSA-N |
Product Overview
2-Nitro-5-(trichloromethylsulfonylmethyl)furan (CAS 68095-64-7), with molecular formula C6H4Cl3NO5S and molecular weight 306.89 g/mol. IUPAC: 2-nitro-5-(trichloromethylsulfonylmethyl)furan.
Chemical Property Profile of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan
Property Insights of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-5-(trichloromethylsulfonylmethyl)furan. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-5-(trichloromethylsulfonylmethyl)furan. Following Lipinski's Rule of Five, 2-Nitro-5-(trichloromethylsulfonylmethyl)furan has 0 hydrogen bond donor(s) and 5 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 2-Nitro-5-(trichloromethylsulfonylmethyl)furan?
The CAS number of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan is 68095-64-7.
What is the molecular formula of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan?
The molecular formula of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan is C6H4Cl3NO5S.
What is the molecular weight of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan?
The molecular weight of 2-Nitro-5-(trichloromethylsulfonylmethyl)furan is 306.89 g/mol.
Where can I buy 2-Nitro-5-(trichloromethylsulfonylmethyl)furan?
You can request a quote for 2-Nitro-5-(trichloromethylsulfonylmethyl)furan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitro-5-(trichloromethylsulfonylmethyl)furan?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-5-(trichloromethylsulfonylmethyl)furan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.