二苯基亚甲基丙二腈
TL;DR: 二苯基亚甲基丙二腈 (CAS 10394-96-4) is a chemical compound with molecular formula C16H10N2 and molecular weight 230.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯基亚甲基丙二腈
2-benzhydrylidenepropanedinitrile
Also Known As: Dicyan, Diphenylmethylenemalononitrile, Dicyan (antioxidant), TsN 2, Benzhydrylidene malononitrile
| Molecular Formula | C16H10N2 |
|---|---|
| Molecular Weight | 230.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.0844 |
| Heavy Atoms | 18 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 10394-96-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=C(C#N)C#N)C2=CC=CC=C2 |
| InChIKey | KOQMBAGMXLUQDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯基亚甲基丙二腈 (CAS 10394-96-4), with molecular formula C16H10N2 and molecular weight 230.08 g/mol. IUPAC: 2-benzhydrylidenepropanedinitrile.
Chemical Property Profile of 二苯基亚甲基丙二腈
Property Insights of 二苯基亚甲基丙二腈
The XLogP value of 3.5 indicates that 二苯基亚甲基丙二腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 二苯基亚甲基丙二腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯基亚甲基丙二腈 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 二苯基亚甲基丙二腈?
The CAS number of 二苯基亚甲基丙二腈 is 10394-96-4.
What is the molecular formula of 二苯基亚甲基丙二腈?
The molecular formula of 二苯基亚甲基丙二腈 is C16H10N2.
What is the molecular weight of 二苯基亚甲基丙二腈?
The molecular weight of 二苯基亚甲基丙二腈 is 230.08 g/mol.
Where can I buy 二苯基亚甲基丙二腈?
You can request a quote for 二苯基亚甲基丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯基亚甲基丙二腈?
Yes, KEHONG BIO provides custom synthesis services for 二苯基亚甲基丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.