7-异丙硫基庚酸
TL;DR: 7-异丙硫基庚酸 (CAS 101913-77-3) is a chemical compound with molecular formula C10H20O2S and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-异丙硫基庚酸
7-propan-2-ylsulfanylheptanoic acid
Also Known As: 7-propan-2-ylsulfanylheptanoic acid, 7-Isopropylthioheptanoic acid, HEPTANOIC ACID, 7-ISOPROPYLTHIO-, 7-Isopropylthioheptanoicacid, 7-(Isopropylthio)heptanoic acid
| Molecular Formula | C10H20O2S |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 204.11841 |
| Heavy Atoms | 13 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 101913-77-3 |
|---|---|
| SMILES | CC(C)SCCCCCCC(=O)O |
| InChIKey | NFWKZYBIWDXGQR-UHFFFAOYSA-N |
Product Overview
7-异丙硫基庚酸 (CAS 101913-77-3), with molecular formula C10H20O2S and molecular weight 204.12 g/mol. IUPAC: 7-propan-2-ylsulfanylheptanoic acid.
Chemical Property Profile of 7-异丙硫基庚酸
Property Insights of 7-异丙硫基庚酸
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-异丙硫基庚酸. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-异丙硫基庚酸. Following Lipinski's Rule of Five, 7-异丙硫基庚酸 has 1 hydrogen bond donor(s) and 3 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 7-异丙硫基庚酸?
The CAS number of 7-异丙硫基庚酸 is 101913-77-3.
What is the molecular formula of 7-异丙硫基庚酸?
The molecular formula of 7-异丙硫基庚酸 is C10H20O2S.
What is the molecular weight of 7-异丙硫基庚酸?
The molecular weight of 7-异丙硫基庚酸 is 204.12 g/mol.
Where can I buy 7-异丙硫基庚酸?
You can request a quote for 7-异丙硫基庚酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-异丙硫基庚酸?
Yes, KEHONG BIO provides custom synthesis services for 7-异丙硫基庚酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.