![1-Butene, 1-[(1-methylethyl)thio]-, (E)- structure](/static/products/1212/121222-72-8.webp)
1-Butene, 1-[(1-methylethyl)thio]-, (E)-
TL;DR: 1-Butene, 1-[(1-methylethyl)thio]-, (E)- (CAS 121222-72-8) is a chemical compound with molecular formula C7H14S and molecular weight 130.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-ylsulfanylbut-1-ene
Also Known As: 1-propan-2-ylsulfanylbut-1-ene, 1-Butene, 1-[(1-methylethyl)thio]-, (E)-, 1-[(Propan-2-yl)sulfanyl]but-1-ene, 1-Butene,1-[(1-methylethyl)thio]-,(E)
| Molecular Formula | C7H14S |
|---|---|
| Molecular Weight | 130.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.08162 |
| Heavy Atoms | 8 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 121222-72-8 |
|---|---|
| SMILES | CCC=CSC(C)C |
| InChIKey | JALQPMTWIUUJJP-UHFFFAOYSA-N |
Product Overview
1-Butene, 1-[(1-methylethyl)thio]-, (E)- (CAS 121222-72-8), with molecular formula C7H14S and molecular weight 130.08 g/mol. IUPAC: 1-propan-2-ylsulfanylbut-1-ene.
Chemical Property Profile of 1-Butene, 1-[(1-methylethyl)thio]-, (E)-
Property Insights of 1-Butene, 1-[(1-methylethyl)thio]-, (E)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butene, 1-[(1-methylethyl)thio]-, (E)-. With a topological polar surface area (TPSA) of 25.3 Ų, 1-Butene, 1-[(1-methylethyl)thio]-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butene, 1-[(1-methylethyl)thio]-, (E)- has 0 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 1-Butene, 1-[(1-methylethyl)thio]-, (E)-?
The CAS number of 1-Butene, 1-[(1-methylethyl)thio]-, (E)- is 121222-72-8.
What is the molecular formula of 1-Butene, 1-[(1-methylethyl)thio]-, (E)-?
The molecular formula of 1-Butene, 1-[(1-methylethyl)thio]-, (E)- is C7H14S.
What is the molecular weight of 1-Butene, 1-[(1-methylethyl)thio]-, (E)-?
The molecular weight of 1-Butene, 1-[(1-methylethyl)thio]-, (E)- is 130.08 g/mol.
Where can I buy 1-Butene, 1-[(1-methylethyl)thio]-, (E)-?
You can request a quote for 1-Butene, 1-[(1-methylethyl)thio]-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butene, 1-[(1-methylethyl)thio]-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butene, 1-[(1-methylethyl)thio]-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.