1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid
TL;DR: 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid (CAS 56771-66-5) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)acetic acid
Also Known As: 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid, 1,3,4,9-Tetrahydro-2H-pyrido[3,4-b]indole-2-acetic acid, 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid #, 2H-Pyrido[3,4-b]indole-2-acetic acid, 1,3,4,9-tetrahydro-, 2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)acetic acid
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 56.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 56771-66-5 |
|---|---|
| SMILES | C1CN(CC2=C1C3=CC=CC=C3N2)CC(=O)O |
| InChIKey | UXPFUKPPPFAMBJ-UHFFFAOYSA-N |
Product Overview
1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid (CAS 56771-66-5), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)acetic acid.
Chemical Property Profile of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid
Property Insights of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid
The XLogP value of -0.7 indicates that 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.3 Ų, 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid 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 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid?
The CAS number of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid is 56771-66-5.
What is the molecular formula of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid?
The molecular formula of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid is C13H14N2O2.
What is the molecular weight of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid?
The molecular weight of 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid is 230.11 g/mol.
Where can I buy 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid?
You can request a quote for 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4,9-Tetrahydro-2H-beta-carbolin-2-ylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.