1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-
TL;DR: 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- (CAS 71144-38-2) is a chemical compound with molecular formula C8H10FNO2 and molecular weight 171.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-aminoethyl)-3-fluorobenzene-1,2-diol
Also Known As: 5-Fluorodopamine, 5-fluoro dopamine, 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-, 5-(2-aminoethyl)-3-fluorobenzene-1,2-diol, 5-(2-Aminoethyl)-3-fluoro-1,2-benzenediol #
| Molecular Formula | C8H10FNO2 |
|---|---|
| Molecular Weight | 171.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.06955 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 71144-38-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)F)CCN |
| InChIKey | KKKZQVOZPOHVRE-UHFFFAOYSA-N |
Product Overview
1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- (CAS 71144-38-2), with molecular formula C8H10FNO2 and molecular weight 171.07 g/mol. IUPAC: 5-(2-aminoethyl)-3-fluorobenzene-1,2-diol.
Chemical Property Profile of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-
Property Insights of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-. Following Lipinski's Rule of Five, 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- has 3 hydrogen bond donor(s) and 4 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 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-?
The CAS number of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- is 71144-38-2.
What is the molecular formula of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-?
The molecular formula of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- is C8H10FNO2.
What is the molecular weight of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-?
The molecular weight of 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- is 171.07 g/mol.
Where can I buy 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-?
You can request a quote for 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenediol, 5-(2-aminoethyl)-3-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.