1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)
TL;DR: 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) (CAS 66375-39-1) is a chemical compound with molecular formula C16H23NO4S and molecular weight 325.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethanol;5-butylnaphthalene-1-sulfonic acid
Also Known As: 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1), 1-naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol(1:1), 2-aminoethanol; 5-butylnaphthalene-1-sulfonic acid, 5-Butylnaphthalene-1-sulfonic acid--2-aminoethan-1-ol (1/1), 5-Butylnaphthalene-1-sulphonic acid, compound with 2-aminoethanol (1:1)
| Molecular Formula | C16H23NO4S |
|---|---|
| Molecular Weight | 325.13 g/mol |
| LogP | 2.37 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.13477 |
| Heavy Atoms | 22 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 66375-39-1 |
|---|---|
| SMILES | CCCCC1=C2C=CC=C(C2=CC=C1)S(=O)(=O)O.C(CO)N |
| InChIKey | KYQKSJPWPMCTDG-UHFFFAOYSA-N |
Product Overview
1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) (CAS 66375-39-1), with molecular formula C16H23NO4S and molecular weight 325.13 g/mol. IUPAC: 2-aminoethanol;5-butylnaphthalene-1-sulfonic acid.
Chemical Property Profile of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)
Property Insights of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)
The XLogP value of 2.37 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1). The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1). Following Lipinski's Rule of Five, 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) has 3 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 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)?
The CAS number of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) is 66375-39-1.
What is the molecular formula of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)?
The molecular formula of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) is C16H23NO4S.
What is the molecular weight of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)?
The molecular weight of 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) is 325.13 g/mol.
Where can I buy 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)?
You can request a quote for 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthalenesulfonic acid, 5-butyl-, compd. with 2-aminoethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.