双炔失碳醇
TL;DR: 双炔失碳醇 (CAS 1045-29-0) is a chemical compound with molecular formula C7H8ClNO and molecular weight 157.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双炔失碳醇
5-chloro-6-nitrosobicyclo[2.2.1]hept-2-ene
Also Known As: 2-Norbornene, dimer, 5-Chloro-6-nitrosobicyclo(2.2.1)hept-2-ene, 2-Nitroso-3-chloronorborna-5-ene, 5-Chloro-6-nitrosobicyclo[2.2.1]hept-2-ene, 3-chloro-2-nitrosobicyclo[2.2.1]hept-5-ene
| Molecular Formula | C7H8ClNO |
|---|---|
| Molecular Weight | 157.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.02943 |
| Heavy Atoms | 10 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 1045-29-0 |
|---|---|
| SMILES | C1C2C=CC1C(C2N=O)Cl |
| InChIKey | OMCKTTAXCXTOCT-UHFFFAOYSA-N |
Product Overview
双炔失碳醇 (CAS 1045-29-0), with molecular formula C7H8ClNO and molecular weight 157.03 g/mol. IUPAC: 5-chloro-6-nitrosobicyclo[2.2.1]hept-2-ene.
Chemical Property Profile of 双炔失碳醇
Property Insights of 双炔失碳醇
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 双炔失碳醇. With a topological polar surface area (TPSA) of 29.4 Ų, 双炔失碳醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双炔失碳醇 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 双炔失碳醇?
The CAS number of 双炔失碳醇 is 1045-29-0.
What is the molecular formula of 双炔失碳醇?
The molecular formula of 双炔失碳醇 is C7H8ClNO.
What is the molecular weight of 双炔失碳醇?
The molecular weight of 双炔失碳醇 is 157.03 g/mol.
Where can I buy 双炔失碳醇?
You can request a quote for 双炔失碳醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双炔失碳醇?
Yes, KEHONG BIO provides custom synthesis services for 双炔失碳醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.