Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)
TL;DR: Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) (CAS 2391-80-2) is a chemical compound with molecular formula C17H38N2S2 and molecular weight 334.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butylbutan-1-amine;dibutylcarbamodithioic acid
Also Known As: Dibutylammonium dibutyldithiocarbamate, dibutylammoniumdibutyldithiocarbamate, N-butylbutan-1-amine; dibutylcarbamodithioic acid, N-butylbutan-1-amine,dibutylcarbamodithioic acid, Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)
| Molecular Formula | C17H38N2S2 |
|---|---|
| Molecular Weight | 334.25 g/mol |
| LogP | 5.28 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 334.24765 |
| Heavy Atoms | 21 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 2391-80-2 |
|---|---|
| SMILES | CCCCNCCCC.CCCCN(CCCC)C(=S)S |
| InChIKey | YPQOCKOIFRNBQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) (CAS 2391-80-2), with molecular formula C17H38N2S2 and molecular weight 334.25 g/mol. IUPAC: N-butylbutan-1-amine;dibutylcarbamodithioic acid.
Chemical Property Profile of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)
Property Insights of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)
The XLogP value of 5.28 indicates that Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.4 Ų, Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)?
The CAS number of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) is 2391-80-2.
What is the molecular formula of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)?
The molecular formula of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) is C17H38N2S2.
What is the molecular weight of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)?
The molecular weight of Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) is 334.25 g/mol.
Where can I buy Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)?
You can request a quote for Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-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 Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Carbamodithioic acid, N,N-dibutyl-, compd. with N-butyl-1-butanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.