Pyrrolidine, 1-(1,3-butadienyl)-
TL;DR: Pyrrolidine, 1-(1,3-butadienyl)- (CAS 19352-91-1) is a chemical compound with molecular formula C8H13N and molecular weight 123.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-buta-1,3-dienylpyrrolidine
Also Known As: pyrrolidino-butadiene, Pyrrolidine, 1-(1,3-butadienyl)-, 1-buta-1,3-dienylpyrrolidine, 1-(BUTA-1,3-DIEN-1-YL)PYRROLIDINE, RefChem:377925
| Molecular Formula | C8H13N |
|---|---|
| Molecular Weight | 123.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 123.1048 |
| Heavy Atoms | 9 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 19352-91-1 |
|---|---|
| SMILES | C=CC=CN1CCCC1 |
| InChIKey | ODHMALPTDRULKN-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(1,3-butadienyl)- (CAS 19352-91-1), with molecular formula C8H13N and molecular weight 123.10 g/mol. IUPAC: 1-buta-1,3-dienylpyrrolidine.
Chemical Property Profile of Pyrrolidine, 1-(1,3-butadienyl)-
Property Insights of Pyrrolidine, 1-(1,3-butadienyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-(1,3-butadienyl)-. With a topological polar surface area (TPSA) of 3.2 Ų, Pyrrolidine, 1-(1,3-butadienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-(1,3-butadienyl)- 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 Pyrrolidine, 1-(1,3-butadienyl)-?
The CAS number of Pyrrolidine, 1-(1,3-butadienyl)- is 19352-91-1.
What is the molecular formula of Pyrrolidine, 1-(1,3-butadienyl)-?
The molecular formula of Pyrrolidine, 1-(1,3-butadienyl)- is C8H13N.
What is the molecular weight of Pyrrolidine, 1-(1,3-butadienyl)-?
The molecular weight of Pyrrolidine, 1-(1,3-butadienyl)- is 123.10 g/mol.
Where can I buy Pyrrolidine, 1-(1,3-butadienyl)-?
You can request a quote for Pyrrolidine, 1-(1,3-butadienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(1,3-butadienyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(1,3-butadienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.