rel-4-((1R,2S)-2-Aminocyclopropyl)phenol
TL;DR: rel-4-((1R,2S)-2-Aminocyclopropyl)phenol (CAS 727649-20-9) is a chemical compound with molecular formula C9H11NO and molecular weight 149.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1S,2R)-2-aminocyclopropyl]phenol
Also Known As: 4-Hydroxytranylcypromine, 3-ethyl-4-oxopiperidine, 4-Hydroxyphenylcyclopropanamine, 4-[(1S,2R)-2-aminocyclopropyl]phenol, 4-(2-Aminocyclopropyl)phenol
| Molecular Formula | C9H11NO |
|---|---|
| Molecular Weight | 149.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.08406 |
| Heavy Atoms | 11 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 727649-20-9 |
|---|---|
| SMILES | C1[C@H]([C@@H]1N)C2=CC=C(C=C2)O |
| InChIKey | HADIWKXZWHXEDX-DTWKUNHWSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
rel-4-((1R,2S)-2-Aminocyclopropyl)phenol (CAS 727649-20-9), with molecular formula C9H11NO and molecular weight 149.08 g/mol. IUPAC: 4-[(1S,2R)-2-aminocyclopropyl]phenol.
Chemical Property Profile of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol
Property Insights of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rel-4-((1R,2S)-2-Aminocyclopropyl)phenol. With a topological polar surface area (TPSA) of 46.3 Ų, rel-4-((1R,2S)-2-Aminocyclopropyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-4-((1R,2S)-2-Aminocyclopropyl)phenol has 2 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 rel-4-((1R,2S)-2-Aminocyclopropyl)phenol?
The CAS number of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol is 727649-20-9.
What is the molecular formula of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol?
The molecular formula of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol is C9H11NO.
What is the molecular weight of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol?
The molecular weight of rel-4-((1R,2S)-2-Aminocyclopropyl)phenol is 149.08 g/mol.
Where can I buy rel-4-((1R,2S)-2-Aminocyclopropyl)phenol?
You can request a quote for rel-4-((1R,2S)-2-Aminocyclopropyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-4-((1R,2S)-2-Aminocyclopropyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for rel-4-((1R,2S)-2-Aminocyclopropyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.