Einecs 248-261-1
TL;DR: Einecs 248-261-1 (CAS 27147-10-0) is a chemical compound with molecular formula C10H21NO2 and molecular weight 187.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;N,N-dimethylcyclohexanamine
Also Known As: cyclohexyldimethylammoniumacetate, n,n-dimethylcyclohexanaminiumacetate, Cyclohexyldimethylammonium acetate, acetic acid; N,N-dimethylcyclohexanamine, Acetic acid--N,N-dimethylcyclohexanamine (1/1)
| Molecular Formula | C10H21NO2 |
|---|---|
| Molecular Weight | 187.16 g/mol |
| LogP | 1.97 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.15723 |
| Heavy Atoms | 13 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 27147-10-0 |
|---|---|
| SMILES | CC(=O)O.CN(C)C1CCCCC1 |
| InChIKey | LDQFAGZKMFMHFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Einecs 248-261-1 (CAS 27147-10-0), with molecular formula C10H21NO2 and molecular weight 187.16 g/mol. IUPAC: acetic acid;N,N-dimethylcyclohexanamine.
Chemical Property Profile of Einecs 248-261-1
Property Insights of Einecs 248-261-1
The XLogP value of 1.97 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 248-261-1. With a topological polar surface area (TPSA) of 40.5 Ų, Einecs 248-261-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 248-261-1 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 Einecs 248-261-1?
The CAS number of Einecs 248-261-1 is 27147-10-0.
What is the molecular formula of Einecs 248-261-1?
The molecular formula of Einecs 248-261-1 is C10H21NO2.
What is the molecular weight of Einecs 248-261-1?
The molecular weight of Einecs 248-261-1 is 187.16 g/mol.
Where can I buy Einecs 248-261-1?
You can request a quote for Einecs 248-261-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 248-261-1?
Yes, KEHONG BIO provides custom synthesis services for Einecs 248-261-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.