2-(1-乙氧基亚丙基)丙二腈
TL;DR: 2-(1-乙氧基亚丙基)丙二腈 (CAS 72877-72-6) is a chemical compound with molecular formula C8H10N2O and molecular weight 150.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-乙氧基亚丙基)丙二腈
2-(1-ethoxypropylidene)propanedinitrile
Also Known As: 2-(1-Ethoxypropylidene)malononitrile, 2- malononitrile, 2-(1-ethoxypropylidene)propanedinitrile, Ethoxypropylidene malononitrile, 2-(1-Ethoxy-propylidene)-malononitrile
| Molecular Formula | C8H10N2O |
|---|---|
| Molecular Weight | 150.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.07932 |
| Heavy Atoms | 11 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 72877-72-6 |
|---|---|
| SMILES | CCC(=C(C#N)C#N)OCC |
| InChIKey | GXMOSBIOUZALPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-乙氧基亚丙基)丙二腈 (CAS 72877-72-6), with molecular formula C8H10N2O and molecular weight 150.08 g/mol. IUPAC: 2-(1-ethoxypropylidene)propanedinitrile.
Chemical Property Profile of 2-(1-乙氧基亚丙基)丙二腈
Property Insights of 2-(1-乙氧基亚丙基)丙二腈
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-乙氧基亚丙基)丙二腈. With a topological polar surface area (TPSA) of 56.8 Ų, 2-(1-乙氧基亚丙基)丙二腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-乙氧基亚丙基)丙二腈 has 0 hydrogen bond donor(s) and 3 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-(1-乙氧基亚丙基)丙二腈?
The CAS number of 2-(1-乙氧基亚丙基)丙二腈 is 72877-72-6.
What is the molecular formula of 2-(1-乙氧基亚丙基)丙二腈?
The molecular formula of 2-(1-乙氧基亚丙基)丙二腈 is C8H10N2O.
What is the molecular weight of 2-(1-乙氧基亚丙基)丙二腈?
The molecular weight of 2-(1-乙氧基亚丙基)丙二腈 is 150.08 g/mol.
Where can I buy 2-(1-乙氧基亚丙基)丙二腈?
You can request a quote for 2-(1-乙氧基亚丙基)丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-乙氧基亚丙基)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-乙氧基亚丙基)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.