(2-羟基-1-萘基亚甲基)丙二腈
TL;DR: (2-羟基-1-萘基亚甲基)丙二腈 (CAS 101756-32-5) is a chemical compound with molecular formula C14H8N2O and molecular weight 220.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-羟基-1-萘基亚甲基)丙二腈
2-[(2-hydroxynaphthalen-1-yl)methylidene]propanedinitrile
Also Known As: (2-Hydroxy-1-(naphthylmethylene))malononitrile, MALONONITRILE, (2-HYDROXY-1-(NAPHTHYLMETHYLENE))-, 2-Hydroxy-1-naphthylmethylenemalononitrile, NCI60_022004, 2-((2-Hydroxy-1-naphthyl)methylene)malononitrile
| Molecular Formula | C14H8N2O |
|---|---|
| Molecular Weight | 220.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.06366 |
| Heavy Atoms | 17 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 101756-32-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)C#N)O |
| InChIKey | UCDYXURSVIOOCB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-羟基-1-萘基亚甲基)丙二腈 (CAS 101756-32-5), with molecular formula C14H8N2O and molecular weight 220.06 g/mol. IUPAC: 2-[(2-hydroxynaphthalen-1-yl)methylidene]propanedinitrile.
Chemical Property Profile of (2-羟基-1-萘基亚甲基)丙二腈
Property Insights of (2-羟基-1-萘基亚甲基)丙二腈
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-羟基-1-萘基亚甲基)丙二腈. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-羟基-1-萘基亚甲基)丙二腈. Following Lipinski's Rule of Five, (2-羟基-1-萘基亚甲基)丙二腈 has 1 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-羟基-1-萘基亚甲基)丙二腈?
The CAS number of (2-羟基-1-萘基亚甲基)丙二腈 is 101756-32-5.
What is the molecular formula of (2-羟基-1-萘基亚甲基)丙二腈?
The molecular formula of (2-羟基-1-萘基亚甲基)丙二腈 is C14H8N2O.
What is the molecular weight of (2-羟基-1-萘基亚甲基)丙二腈?
The molecular weight of (2-羟基-1-萘基亚甲基)丙二腈 is 220.06 g/mol.
Where can I buy (2-羟基-1-萘基亚甲基)丙二腈?
You can request a quote for (2-羟基-1-萘基亚甲基)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-羟基-1-萘基亚甲基)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for (2-羟基-1-萘基亚甲基)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.