InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H
TL;DR: InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H (CAS 271768-24-2) is a chemical compound with molecular formula C9H13ClO and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propylbicyclo[1.1.1]pentane-1-carbonyl chloride
Also Known As: J1.284.824B, 1-propylbicyclo[1.1.1]pentane-3-carbonyl Chloride, 3-propylbicyclo[1.1.1]pentane-1-carbonyl chloride, 3-Propylbicyclo[1.1.1]pentane-1-carboxylic acid chloride, Bicyclo[1.1.1]pentane-1-carbonyl chloride, 3-propyl- (9CI)
| Molecular Formula | C9H13ClO |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 2.7222 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.06549 |
| Heavy Atoms | 11 |
| Complexity | 189.83383 |
Chemical Identifiers
| CAS Number | 271768-24-2 |
|---|---|
| SMILES | CCCC12CC(C1)(C2)C(=O)Cl |
Product Overview
InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H (CAS 271768-24-2), with molecular formula C9H13ClO and molecular weight 172.07 g/mol. IUPAC: 3-propylbicyclo[1.1.1]pentane-1-carbonyl chloride.
Chemical Property Profile of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H
Property Insights of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H
The XLogP value of 2.7222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H. With a topological polar surface area (TPSA) of 17.07 Ų, InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H has 0 hydrogen bond donor(s) and 1 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 InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H?
The CAS number of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H is 271768-24-2.
What is the molecular formula of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H?
The molecular formula of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H is C9H13ClO.
What is the molecular weight of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H?
The molecular weight of InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H is 172.07 g/mol.
Where can I buy InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H?
You can request a quote for InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C9H13ClO/c1-2-3-8-4-9(5-8,6-8)7(10)11/h2-6H2,1H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.