1-Cyclohexanecarbamic acid, 1-cyanodithio-
TL;DR: 1-Cyclohexanecarbamic acid, 1-cyanodithio- (CAS 69352-84-7) is a chemical compound with molecular formula C8H12N2S2 and molecular weight 200.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-cyanocyclohexyl)carbamodithioic acid
Also Known As: 1-Cyanocyclohexanedithiocarbamic acid, 1-Cyclohexanecarbamic acid, 1-cyanodithio-, (1-cyanocyclohexyl)carbamodithioic acid, (Cyano-1 cyclohexyl)-N dithiocarbamique, 1-Cyanocyclohexanecarbamodithioic acid
| Molecular Formula | C8H12N2S2 |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 2.01718 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.04419 |
| Heavy Atoms | 12 |
| Complexity | 213.58798 |
Chemical Identifiers
| CAS Number | 69352-84-7 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)NC(=S)S |
Product Overview
1-Cyclohexanecarbamic acid, 1-cyanodithio- (CAS 69352-84-7), with molecular formula C8H12N2S2 and molecular weight 200.04 g/mol. IUPAC: (1-cyanocyclohexyl)carbamodithioic acid.
Chemical Property Profile of 1-Cyclohexanecarbamic acid, 1-cyanodithio-
Property Insights of 1-Cyclohexanecarbamic acid, 1-cyanodithio-
The XLogP value of 2.01718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Cyclohexanecarbamic acid, 1-cyanodithio-. With a topological polar surface area (TPSA) of 35.82 Ų, 1-Cyclohexanecarbamic acid, 1-cyanodithio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Cyclohexanecarbamic acid, 1-cyanodithio- has 2 hydrogen bond donor(s) and 2 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-Cyclohexanecarbamic acid, 1-cyanodithio-?
The CAS number of 1-Cyclohexanecarbamic acid, 1-cyanodithio- is 69352-84-7.
What is the molecular formula of 1-Cyclohexanecarbamic acid, 1-cyanodithio-?
The molecular formula of 1-Cyclohexanecarbamic acid, 1-cyanodithio- is C8H12N2S2.
What is the molecular weight of 1-Cyclohexanecarbamic acid, 1-cyanodithio-?
The molecular weight of 1-Cyclohexanecarbamic acid, 1-cyanodithio- is 200.04 g/mol.
Where can I buy 1-Cyclohexanecarbamic acid, 1-cyanodithio-?
You can request a quote for 1-Cyclohexanecarbamic acid, 1-cyanodithio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyclohexanecarbamic acid, 1-cyanodithio-?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyclohexanecarbamic acid, 1-cyanodithio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.