EC 500-181-0
TL;DR: EC 500-181-0 (CAS 68002-42-6) is a chemical compound with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)oxirane;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;2-methyl-1H-imidazole
Also Known As: EC 500-181-0, 500-181-0 (NLP #), (C15-H16-O2.C4-H6-N2.C3-H5-Cl-O)x-, Bisphenol A, epichlorohydrin polymer, reaction product with 2-methylimidazole, Bisphenol A, epichlorohydrin polymer, 2-methylimidazole condensate
| Molecular Formula | C22H27ClN2O3 |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 4.76582 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.17102 |
| Heavy Atoms | 28 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 68002-42-6 |
|---|---|
| SMILES | CC1=NC=CN1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl |
| InChIKey | UMZCEEAEMVVBAU-UHFFFAOYSA-N |
Product Overview
EC 500-181-0 (CAS 68002-42-6), with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol. IUPAC: 2-(chloromethyl)oxirane;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;2-methyl-1H-imidazole.
Chemical Property Profile of EC 500-181-0
Property Insights of EC 500-181-0
The XLogP value of 4.76582 indicates that EC 500-181-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for EC 500-181-0. Following Lipinski's Rule of Five, EC 500-181-0 has 3 hydrogen bond donor(s) and 4 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 EC 500-181-0?
The CAS number of EC 500-181-0 is 68002-42-6.
What is the molecular formula of EC 500-181-0?
The molecular formula of EC 500-181-0 is C22H27ClN2O3.
What is the molecular weight of EC 500-181-0?
The molecular weight of EC 500-181-0 is 402.17 g/mol.
Where can I buy EC 500-181-0?
You can request a quote for EC 500-181-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EC 500-181-0?
Yes, KEHONG BIO provides custom synthesis services for EC 500-181-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.