2,2-Dimethylvaleroyl chloride
TL;DR: 2,2-Dimethylvaleroyl chloride (CAS 15721-22-9) is a chemical compound with molecular formula C7H13ClO and molecular weight 148.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpentanoyl chloride
Also Known As: 2,2-Dimethylvaleroyl chloride, 2,2-Dimethylpentanoyl chloride, Pentanoyl chloride, 2,2-dimethyl-, HEPTANOYL CHLORIDE, 2,2-Dimethyl valeroyl chloride
| Molecular Formula | C7H13ClO |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.06549 |
| Heavy Atoms | 9 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 15721-22-9 |
|---|---|
| SMILES | CCCC(C)(C)C(=O)Cl |
| InChIKey | NUBKYCCXDNYHLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethylvaleroyl chloride (CAS 15721-22-9), with molecular formula C7H13ClO and molecular weight 148.07 g/mol. IUPAC: 2,2-dimethylpentanoyl chloride.
Chemical Property Profile of 2,2-Dimethylvaleroyl chloride
Property Insights of 2,2-Dimethylvaleroyl chloride
The XLogP value of 3.1 indicates that 2,2-Dimethylvaleroyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,2-Dimethylvaleroyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethylvaleroyl chloride 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 2,2-Dimethylvaleroyl chloride?
The CAS number of 2,2-Dimethylvaleroyl chloride is 15721-22-9.
What is the molecular formula of 2,2-Dimethylvaleroyl chloride?
The molecular formula of 2,2-Dimethylvaleroyl chloride is C7H13ClO.
What is the molecular weight of 2,2-Dimethylvaleroyl chloride?
The molecular weight of 2,2-Dimethylvaleroyl chloride is 148.07 g/mol.
Where can I buy 2,2-Dimethylvaleroyl chloride?
You can request a quote for 2,2-Dimethylvaleroyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethylvaleroyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethylvaleroyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.