Hexahydro-1H-pyrrolizine-7a-carbaldehyde
TL;DR: Hexahydro-1H-pyrrolizine-7a-carbaldehyde (CAS 474010-98-5) is a chemical compound with molecular formula C8H13NO and molecular weight 139.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,5,6,7-hexahydropyrrolizine-8-carbaldehyde
Also Known As: Hexahydro-1H-pyrrolizine-7a-carbaldehyde, 1,2,3,5,6,7-hexahydropyrrolizine-8-carbaldehyde, Tetrahydro-1H-pyrrolizine-7a(5H)-carbaldehyde, 5-Azabicyclo[3.3.0]octanecarboxaldehyde, NCI60_034722
| Molecular Formula | C8H13NO |
|---|---|
| Molecular Weight | 139.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.09972 |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 474010-98-5 |
|---|---|
| SMILES | C1CC2(CCCN2C1)C=O |
| InChIKey | VVWRHELZTWIQIE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexahydro-1H-pyrrolizine-7a-carbaldehyde (CAS 474010-98-5), with molecular formula C8H13NO and molecular weight 139.10 g/mol. IUPAC: 1,2,3,5,6,7-hexahydropyrrolizine-8-carbaldehyde.
Chemical Property Profile of Hexahydro-1H-pyrrolizine-7a-carbaldehyde
Property Insights of Hexahydro-1H-pyrrolizine-7a-carbaldehyde
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-1H-pyrrolizine-7a-carbaldehyde. With a topological polar surface area (TPSA) of 20.3 Ų, Hexahydro-1H-pyrrolizine-7a-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-1H-pyrrolizine-7a-carbaldehyde 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 Hexahydro-1H-pyrrolizine-7a-carbaldehyde?
The CAS number of Hexahydro-1H-pyrrolizine-7a-carbaldehyde is 474010-98-5.
What is the molecular formula of Hexahydro-1H-pyrrolizine-7a-carbaldehyde?
The molecular formula of Hexahydro-1H-pyrrolizine-7a-carbaldehyde is C8H13NO.
What is the molecular weight of Hexahydro-1H-pyrrolizine-7a-carbaldehyde?
The molecular weight of Hexahydro-1H-pyrrolizine-7a-carbaldehyde is 139.10 g/mol.
Where can I buy Hexahydro-1H-pyrrolizine-7a-carbaldehyde?
You can request a quote for Hexahydro-1H-pyrrolizine-7a-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-1H-pyrrolizine-7a-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-1H-pyrrolizine-7a-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.