1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile
TL;DR: 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile (CAS 9052-77-1) is a chemical compound with molecular formula C17H19N and molecular weight 237.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile
Also Known As: 2-Propenenitrile, polymer with 1,3-butadiene and diethenylbenzene, (C10-H10.C4-H6.C3-H3-N)x-, buta-1,3-diene; 1,2-divinylbenzene; prop-2-enenitrile, buta-1,3-diene; 1,2-diethenylbenzene; prop-2-enenitrile, 1,2-bis(ethenyl)benzene; buta-1,3-diene; prop-2-enenitrile
| Molecular Formula | C17H19N |
|---|---|
| Molecular Weight | 237.15 g/mol |
| LogP | 5.02698 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.15175 |
| Heavy Atoms | 18 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 9052-77-1 |
|---|---|
| SMILES | C=CC=C.C=CC#N.C=CC1=CC=CC=C1C=C |
| InChIKey | JBKUNRMJBXFKDH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile (CAS 9052-77-1), with molecular formula C17H19N and molecular weight 237.15 g/mol. IUPAC: 1,2-bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile.
Chemical Property Profile of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile
Property Insights of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile
The XLogP value of 5.02698 indicates that 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile?
The CAS number of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile is 9052-77-1.
What is the molecular formula of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile?
The molecular formula of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile is C17H19N.
What is the molecular weight of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile?
The molecular weight of 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile is 237.15 g/mol.
Where can I buy 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile?
You can request a quote for 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Bis(ethenyl)benzene;buta-1,3-diene;prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.