Carbamodithioic acid, pentyl-
TL;DR: Carbamodithioic acid, pentyl- (CAS 19058-92-5) is a chemical compound with molecular formula C6H13NS2 and molecular weight 163.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentylcarbamodithioic acid
Also Known As: pentylcarbamodithioic acid, Carbamodithioic acid, pentyl-, Pentyldithiocarbamic acid, ~{N}-tridecylmethanethioamide, (pentylamino)methanedithioic Acid
| Molecular Formula | C6H13NS2 |
|---|---|
| Molecular Weight | 163.05 g/mol |
| LogP | 1.9809 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.04893 |
| Heavy Atoms | 9 |
| Complexity | 83.127045 |
Chemical Identifiers
| CAS Number | 19058-92-5 |
|---|---|
| SMILES | CCCCCNC(=S)S |
Product Overview
Carbamodithioic acid, pentyl- (CAS 19058-92-5), with molecular formula C6H13NS2 and molecular weight 163.05 g/mol. IUPAC: pentylcarbamodithioic acid.
Chemical Property Profile of Carbamodithioic acid, pentyl-
Property Insights of Carbamodithioic acid, pentyl-
The XLogP value of 1.9809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamodithioic acid, pentyl-. With a topological polar surface area (TPSA) of 12.03 Ų, Carbamodithioic acid, pentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamodithioic acid, pentyl- has 2 hydrogen bond donor(s) and 1 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 Carbamodithioic acid, pentyl-?
The CAS number of Carbamodithioic acid, pentyl- is 19058-92-5.
What is the molecular formula of Carbamodithioic acid, pentyl-?
The molecular formula of Carbamodithioic acid, pentyl- is C6H13NS2.
What is the molecular weight of Carbamodithioic acid, pentyl-?
The molecular weight of Carbamodithioic acid, pentyl- is 163.05 g/mol.
Where can I buy Carbamodithioic acid, pentyl-?
You can request a quote for Carbamodithioic acid, pentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamodithioic acid, pentyl-?
Yes, KEHONG BIO provides custom synthesis services for Carbamodithioic acid, pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.