Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)
TL;DR: Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) (CAS 67970-28-9) is a chemical compound with molecular formula C22H35NO3S and molecular weight 393.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-1-amine;2,3-dibutylnaphthalene-1-sulfonic acid
Also Known As: Dibutylnaphthalenesulfonic acid, butylamine salt, Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1), Dibutylnaphthalenesulphonic acid, compound with butylamine (1:1), butan-1-amine; 2,3-dibutylnaphthalene-1-sulfonic acid, 2,3-Dibutylnaphthalene-1-sulfonic acid--butan-1-amine (1/1)
| Molecular Formula | C22H35NO3S |
|---|---|
| Molecular Weight | 393.23 g/mol |
| LogP | 5.5169 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 393.23376 |
| Heavy Atoms | 27 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 67970-28-9 |
|---|---|
| SMILES | CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O.CCCCN |
| InChIKey | WZJFYALNAZEBHJ-UHFFFAOYSA-N |
Product Overview
Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) (CAS 67970-28-9), with molecular formula C22H35NO3S and molecular weight 393.23 g/mol. IUPAC: butan-1-amine;2,3-dibutylnaphthalene-1-sulfonic acid.
Chemical Property Profile of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)
Property Insights of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)
The XLogP value of 5.5169 indicates that Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1). Following Lipinski's Rule of Five, Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)?
The CAS number of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) is 67970-28-9.
What is the molecular formula of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)?
The molecular formula of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) is C22H35NO3S.
What is the molecular weight of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)?
The molecular weight of Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) is 393.23 g/mol.
Where can I buy Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)?
You can request a quote for Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Naphthalenesulfonic acid, dibutyl-, compd. with 1-butanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.