3'-Hydroxycotinine, trans-
TL;DR: 3'-Hydroxycotinine, trans- (CAS 34834-67-8) is a chemical compound with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5S)-3-hydroxy-1-methyl-5-pyridin-3-ylpyrrolidin-2-one
Also Known As: Hydroxycotinine, trans-3'-hydroxycotinine, trans-3-Hydroxycotinine, 3-Hydroxycotinine, 3'-hydroxycotinine
| Molecular Formula | C10H12N2O2 |
|---|---|
| Molecular Weight | 192.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 53.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.08987 |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 34834-67-8 |
|---|---|
| SMILES | CN1[C@@H](C[C@H](C1=O)O)C2=CN=CC=C2 |
| InChIKey | XOKCJXZZNAUIQN-DTWKUNHWSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-Hydroxycotinine, trans- (CAS 34834-67-8), with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol. IUPAC: (3R,5S)-3-hydroxy-1-methyl-5-pyridin-3-ylpyrrolidin-2-one.
Chemical Property Profile of 3'-Hydroxycotinine, trans-
Property Insights of 3'-Hydroxycotinine, trans-
The XLogP value of -0.9 indicates that 3'-Hydroxycotinine, trans- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.4 Ų, 3'-Hydroxycotinine, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Hydroxycotinine, trans- has 1 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 3'-Hydroxycotinine, trans-?
The CAS number of 3'-Hydroxycotinine, trans- is 34834-67-8.
What is the molecular formula of 3'-Hydroxycotinine, trans-?
The molecular formula of 3'-Hydroxycotinine, trans- is C10H12N2O2.
What is the molecular weight of 3'-Hydroxycotinine, trans-?
The molecular weight of 3'-Hydroxycotinine, trans- is 192.09 g/mol.
Where can I buy 3'-Hydroxycotinine, trans-?
You can request a quote for 3'-Hydroxycotinine, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Hydroxycotinine, trans-?
Yes, KEHONG BIO provides custom synthesis services for 3'-Hydroxycotinine, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.