![3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile structure](/static/products/5552/55526-40-4.webp)
3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile
TL;DR: 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile (CAS 55526-40-4) is a chemical compound with molecular formula C9H14N2O2 and molecular weight 182.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(2-cyanoethoxy)propoxy]propanenitrile
Also Known As: 4,8-Dioxa-undecandinitril, 4,8-dioxa-undecanedinitrile, 3,3'-[propane-1,3-diylbis(oxy)]dipropanenitrile, 3-[3-(2-cyanoethoxy)propoxy]propanenitrile, 4-[(4-cyanophenyl)disulfanyl]benzonitrile
| Molecular Formula | C9H14N2O2 |
|---|---|
| Molecular Weight | 182.11 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 182.10553 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 55526-40-4 |
|---|---|
| SMILES | C(COCCC#N)COCCC#N |
| InChIKey | PPHVNJZVJZMSRM-UHFFFAOYSA-N |
Product Overview
3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile (CAS 55526-40-4), with molecular formula C9H14N2O2 and molecular weight 182.11 g/mol. IUPAC: 3-[3-(2-cyanoethoxy)propoxy]propanenitrile.
Chemical Property Profile of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile
Property Insights of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile
The XLogP value of -0.3 indicates that 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile. Following Lipinski's Rule of Five, 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile has 0 hydrogen bond donor(s) and 4 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 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile?
The CAS number of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile is 55526-40-4.
What is the molecular formula of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile?
The molecular formula of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile is C9H14N2O2.
What is the molecular weight of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile?
The molecular weight of 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile is 182.11 g/mol.
Where can I buy 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile?
You can request a quote for 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-[Propane-1,3-diylbis(oxy)]dipropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.