2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇
TL;DR: 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 (CAS 188745-06-4) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇
2-(4-aminophenyl)-5-(hydroxymethyl)pyrrolidine-3,4-diol
Also Known As: 2-(4-aminophenyl)-5-(hydroxymethyl)pyrrolidine-3,4-diol, 3,4-Pyrrolidinediol, 2-(4-aminophenyl)-5-(hydroxymethyl)-, (2S,3S,4R,5R)-, 2-(4-amino-phenyl)-5-hydroxymethyl-pyrrolidine-3,4-diol, PIR, RefChem:486427
| Molecular Formula | C11H16N2O3 |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.11609 |
| Heavy Atoms | 16 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 188745-06-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2C(C(C(N2)CO)O)O)N |
| InChIKey | SQENVZNKXLCDLF-UHFFFAOYSA-N |
Product Overview
2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 (CAS 188745-06-4), with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol. IUPAC: 2-(4-aminophenyl)-5-(hydroxymethyl)pyrrolidine-3,4-diol.
Chemical Property Profile of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇
Property Insights of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇
The XLogP value of -0.9 indicates that 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇. Following Lipinski's Rule of Five, 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 has 5 hydrogen bond donor(s) and 5 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 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇?
The CAS number of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 is 188745-06-4.
What is the molecular formula of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇?
The molecular formula of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 is C11H16N2O3.
What is the molecular weight of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇?
The molecular weight of 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 is 224.12 g/mol.
Where can I buy 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇?
You can request a quote for 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-氨基苯基)-5-(羟甲基)吡咯烷-3,4-二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.