RefChem:210180
TL;DR: RefChem:210180 (CAS 16700-28-0) is a chemical compound with molecular formula C18H34NO7P and molecular weight 407.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-[1-(4-hydroxycyclohexyl)cyclohex-2-en-1-yl]acetate;phosphoric acid
Also Known As: 2-Dimethylaminoethyl 4-(4-hydroxycyclohexyl)-delta(sup 1,alpha)-cyclohexaneacetate phosphate, (Bicyclohexyl)-delta(sup 4,alpha)-acetic acid, 4'-hydroxy-, 2-(dimethylamino)ethyl ester, phosphate (1:1) (salt), (+-)-, 2-dimethylaminoethyl 2-[1-(4-hydroxycyclohexyl)cyclohex-2-en-1-yl]acetate; phosphoric acid, Phosphoric acid--2-(dimethylamino)ethyl [4'-hydroxy[[1,1'-bi(cyclohexan)]-2-en]-1-yl]acetate (1/1), RefChem:210180
| Molecular Formula | C18H34NO7P |
|---|---|
| Molecular Weight | 407.21 g/mol |
| LogP | 1.8303 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.20728 |
| Heavy Atoms | 27 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 16700-28-0 |
|---|---|
| SMILES | CN(C)CCOC(=O)CC1(CCCC=C1)C2CCC(CC2)O.OP(=O)(O)O |
| InChIKey | FEDKNTROKHLXLS-UHFFFAOYSA-N |
Product Overview
RefChem:210180 (CAS 16700-28-0), with molecular formula C18H34NO7P and molecular weight 407.21 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-[1-(4-hydroxycyclohexyl)cyclohex-2-en-1-yl]acetate;phosphoric acid.
Chemical Property Profile of RefChem:210180
Property Insights of RefChem:210180
The XLogP value of 1.8303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:210180. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:210180. Following Lipinski's Rule of Five, RefChem:210180 has 4 hydrogen bond donor(s) and 8 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 RefChem:210180?
The CAS number of RefChem:210180 is 16700-28-0.
What is the molecular formula of RefChem:210180?
The molecular formula of RefChem:210180 is C18H34NO7P.
What is the molecular weight of RefChem:210180?
The molecular weight of RefChem:210180 is 407.21 g/mol.
Where can I buy RefChem:210180?
You can request a quote for RefChem:210180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:210180?
Yes, KEHONG BIO provides custom synthesis services for RefChem:210180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.