Butane, 2-bromo-2-nitro-
TL;DR: Butane, 2-bromo-2-nitro- (CAS 6340-74-5) is a chemical compound with molecular formula C4H8BrNO2 and molecular weight 180.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-2-nitrobutane
Also Known As: 2-bromo-2-nitrobutane, Butane, 2-bromo-2-nitro-, 2-bromo-2-nitro-butane, 2-Brom-2-nitrobutan
| Molecular Formula | C4H8BrNO2 |
|---|---|
| Molecular Weight | 180.97 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.97385 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 6340-74-5 |
|---|---|
| SMILES | CCC(C)([N+](=O)[O-])Br |
| InChIKey | GKWKBYDWIWHRCZ-UHFFFAOYSA-N |
Product Overview
Butane, 2-bromo-2-nitro- (CAS 6340-74-5), with molecular formula C4H8BrNO2 and molecular weight 180.97 g/mol. IUPAC: 2-bromo-2-nitrobutane.
Chemical Property Profile of Butane, 2-bromo-2-nitro-
Property Insights of Butane, 2-bromo-2-nitro-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 2-bromo-2-nitro-. With a topological polar surface area (TPSA) of 45.8 Ų, Butane, 2-bromo-2-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 2-bromo-2-nitro- 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 Butane, 2-bromo-2-nitro-?
The CAS number of Butane, 2-bromo-2-nitro- is 6340-74-5.
What is the molecular formula of Butane, 2-bromo-2-nitro-?
The molecular formula of Butane, 2-bromo-2-nitro- is C4H8BrNO2.
What is the molecular weight of Butane, 2-bromo-2-nitro-?
The molecular weight of Butane, 2-bromo-2-nitro- is 180.97 g/mol.
Where can I buy Butane, 2-bromo-2-nitro-?
You can request a quote for Butane, 2-bromo-2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 2-bromo-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 2-bromo-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.