(2Z)-2-bromobut-2-enal
TL;DR: (2Z)-2-bromobut-2-enal (CAS 55947-13-2) is a chemical compound with molecular formula C4H5BrO and molecular weight 147.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-bromobut-2-enal
Also Known As: 2-bromobut-2-enal, 2-Bromocrotonaldehyde, (Z)-2-bromobut-2-enal, 2-Bromo-2-butenal, alpha-Bromocrotonaldehyde
| Molecular Formula | C4H5BrO |
|---|---|
| Molecular Weight | 147.95 g/mol |
| LogP | 1.484 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.95238 |
| Heavy Atoms | 6 |
| Complexity | 75.61727 |
Chemical Identifiers
| CAS Number | 55947-13-2 |
|---|---|
| SMILES | C/C=C(/C=O)\Br |
Product Overview
(2Z)-2-bromobut-2-enal (CAS 55947-13-2), with molecular formula C4H5BrO and molecular weight 147.95 g/mol. IUPAC: (Z)-2-bromobut-2-enal.
Chemical Property Profile of (2Z)-2-bromobut-2-enal
Property Insights of (2Z)-2-bromobut-2-enal
The XLogP value of 1.484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-2-bromobut-2-enal. With a topological polar surface area (TPSA) of 17.07 Ų, (2Z)-2-bromobut-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-bromobut-2-enal has 0 hydrogen bond donor(s) and 1 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 (2Z)-2-bromobut-2-enal?
The CAS number of (2Z)-2-bromobut-2-enal is 55947-13-2.
What is the molecular formula of (2Z)-2-bromobut-2-enal?
The molecular formula of (2Z)-2-bromobut-2-enal is C4H5BrO.
What is the molecular weight of (2Z)-2-bromobut-2-enal?
The molecular weight of (2Z)-2-bromobut-2-enal is 147.95 g/mol.
Where can I buy (2Z)-2-bromobut-2-enal?
You can request a quote for (2Z)-2-bromobut-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-bromobut-2-enal?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-bromobut-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.