2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-
TL;DR: 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- (CAS 70133-97-0) is a chemical compound with molecular formula C8H13NS and molecular weight 155.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5,5-dimethylcyclohex-2-ene-1-thione
Also Known As: 3-amino-5,5-dimethylcyclohex-2-ene-1-thione, 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-, 3-Amino-5,5-dimethyl-2-cyclohexene-1-thione, 3-amino-5,5-dimethyl-cyclohex-2-ene-1-thione, RefChem:259859
| Molecular Formula | C8H13NS |
|---|---|
| Molecular Weight | 155.08 g/mol |
| LogP | 2.0189 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 155.07687 |
| Heavy Atoms | 10 |
| Complexity | 191.43427 |
Chemical Identifiers
| CAS Number | 70133-97-0 |
|---|---|
| SMILES | CC1(CC(=CC(=S)C1)N)C |
Product Overview
2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- (CAS 70133-97-0), with molecular formula C8H13NS and molecular weight 155.08 g/mol. IUPAC: 3-amino-5,5-dimethylcyclohex-2-ene-1-thione.
Chemical Property Profile of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-
Property Insights of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-
The XLogP value of 2.0189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-. With a topological polar surface area (TPSA) of 26.02 Ų, 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- has 1 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 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-?
The CAS number of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- is 70133-97-0.
What is the molecular formula of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-?
The molecular formula of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- is C8H13NS.
What is the molecular weight of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-?
The molecular weight of 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- is 155.08 g/mol.
Where can I buy 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-?
You can request a quote for 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexene-1-thione, 3-amino-5,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.