azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene
TL;DR: azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene (CAS 67801-75-6) is a chemical compound with molecular formula C16H21NO4 and molecular weight 291.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene
Also Known As: (C8-H8.C4-H6.C4-H4-O4)x-.x-H3-N, Fumaric acid, styrene, butadiene polymer, ammonium salt, Fumaric acid, styrene, butadiene polymer ammonium salt, 2-Butenedioic acid (2E)-, polymer with 1,3-butadiene and ethenylbenzene, ammonium salt, azanium; buta-1,3-diene; (E)-4-hydroxy-4-oxobut-2-enoate; styrene
| Molecular Formula | C16H21NO4 |
|---|---|
| Molecular Weight | 291.15 g/mol |
| LogP | 2.4413 |
| Topological Polar Surface Area | 113.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.14706 |
| Heavy Atoms | 21 |
| Complexity | 442.42514 |
Chemical Identifiers
| CAS Number | 67801-75-6 |
|---|---|
| SMILES | C=CC=C.C=CC1=CC=CC=C1.C(=C/C(=O)[O-])\C(=O)O.[NH4+] |
Product Overview
azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene (CAS 67801-75-6), with molecular formula C16H21NO4 and molecular weight 291.15 g/mol. IUPAC: azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene.
Chemical Property Profile of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene
Property Insights of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene
The XLogP value of 2.4413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene. The TPSA of 113.93 Ų falls within the moderate polarity range, balancing permeability and solubility for azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene. Following Lipinski's Rule of Five, azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene has 2 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 azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene?
The CAS number of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene is 67801-75-6.
What is the molecular formula of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene?
The molecular formula of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene is C16H21NO4.
What is the molecular weight of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene?
The molecular weight of azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene is 291.15 g/mol.
Where can I buy azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene?
You can request a quote for azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene?
Yes, KEHONG BIO provides custom synthesis services for azanium;buta-1,3-diene;(E)-4-hydroxy-4-oxobut-2-enoate;styrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.