表美雌醇
TL;DR: 表美雌醇 (CAS 7004-98-0) is a chemical compound with molecular formula C17H17Cl2N and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
表美雌醇
2-chloro-2,2-diphenyl-N-propan-2-ylethanimidoyl chloride
Also Known As: KST-1A7683, (1z)-2-chloro-2,2-diphenyl-n-(propan-2-yl)ethanimidoyl chloride, 2-chloro-2,2-diphenyl-N-propan-2-ylethanimidoyl chloride
| Molecular Formula | C17H17Cl2N |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.0738 |
| Heavy Atoms | 20 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 7004-98-0 |
|---|---|
| SMILES | CC(C)N=C(C(C1=CC=CC=C1)(C2=CC=CC=C2)Cl)Cl |
| InChIKey | JKYZFHMFWWMAEY-UHFFFAOYSA-N |
Product Overview
表美雌醇 (CAS 7004-98-0), with molecular formula C17H17Cl2N and molecular weight 305.07 g/mol. IUPAC: 2-chloro-2,2-diphenyl-N-propan-2-ylethanimidoyl chloride.
Chemical Property Profile of 表美雌醇
Property Insights of 表美雌醇
The XLogP value of 5.5 indicates that 表美雌醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, 表美雌醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 表美雌醇 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 表美雌醇?
The CAS number of 表美雌醇 is 7004-98-0.
What is the molecular formula of 表美雌醇?
The molecular formula of 表美雌醇 is C17H17Cl2N.
What is the molecular weight of 表美雌醇?
The molecular weight of 表美雌醇 is 305.07 g/mol.
Where can I buy 表美雌醇?
You can request a quote for 表美雌醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 表美雌醇?
Yes, KEHONG BIO provides custom synthesis services for 表美雌醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.