Thiophene-d4
TL;DR: Thiophene-d4 (CAS 2036-39-7) is a chemical compound with molecular formula C4H4S and molecular weight 88.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetradeuteriothiophene
Also Known As: Thiophene-d4, thiophene-d5, 2,3,4,5-tetradeuteriothiophene, (?H?)thiophene, (2H4)thiophene
| Molecular Formula | C4H4S |
|---|---|
| Molecular Weight | 88.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 88.02848 |
| Heavy Atoms | 5 |
| Complexity | 22.0 |
Chemical Identifiers
| CAS Number | 2036-39-7 |
|---|---|
| SMILES | [2H]C1=C(SC(=C1[2H])[2H])[2H] |
| InChIKey | YTPLMLYBLZKORZ-RHQRLBAQSA-N |
Product Overview
Thiophene-d4 (CAS 2036-39-7), with molecular formula C4H4S and molecular weight 88.03 g/mol. IUPAC: 2,3,4,5-tetradeuteriothiophene.
Chemical Property Profile of Thiophene-d4
Property Insights of Thiophene-d4
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophene-d4. With a topological polar surface area (TPSA) of 28.2 Ų, Thiophene-d4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene-d4 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 Thiophene-d4?
The CAS number of Thiophene-d4 is 2036-39-7.
What is the molecular formula of Thiophene-d4?
The molecular formula of Thiophene-d4 is C4H4S.
What is the molecular weight of Thiophene-d4?
The molecular weight of Thiophene-d4 is 88.03 g/mol.
Where can I buy Thiophene-d4?
You can request a quote for Thiophene-d4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene-d4?
Yes, KEHONG BIO provides custom synthesis services for Thiophene-d4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.