2-氨基-5-氯苯基环己基酮
TL;DR: 2-氨基-5-氯苯基环己基酮 (CAS 1789-30-6) is a chemical compound with molecular formula C13H16ClNO and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-5-氯苯基环己基酮
(2-amino-5-chlorophenyl)-cyclohexylmethanone
Also Known As: (2-amino-5-chlorophenyl)-cyclohexylmethanone, 2-Amino-5-chlorophenyl cyclohexyl ketone, 5-Norbornene-2-phenyl, (2-amino-5-chlorophenyl)(cyclohexyl)methanone, (2-Amino-5-chlorophenyl)cyclohexylmethanone
| Molecular Formula | C13H16ClNO |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.09204 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 1789-30-6 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)C2=C(C=CC(=C2)Cl)N |
| InChIKey | XCKJMNZTSNFNHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基-5-氯苯基环己基酮 (CAS 1789-30-6), with molecular formula C13H16ClNO and molecular weight 237.09 g/mol. IUPAC: (2-amino-5-chlorophenyl)-cyclohexylmethanone.
Chemical Property Profile of 2-氨基-5-氯苯基环己基酮
Property Insights of 2-氨基-5-氯苯基环己基酮
The XLogP value of 4.2 indicates that 2-氨基-5-氯苯基环己基酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 2-氨基-5-氯苯基环己基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氨基-5-氯苯基环己基酮 has 1 hydrogen bond donor(s) and 2 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-氨基-5-氯苯基环己基酮?
The CAS number of 2-氨基-5-氯苯基环己基酮 is 1789-30-6.
What is the molecular formula of 2-氨基-5-氯苯基环己基酮?
The molecular formula of 2-氨基-5-氯苯基环己基酮 is C13H16ClNO.
What is the molecular weight of 2-氨基-5-氯苯基环己基酮?
The molecular weight of 2-氨基-5-氯苯基环己基酮 is 237.09 g/mol.
Where can I buy 2-氨基-5-氯苯基环己基酮?
You can request a quote for 2-氨基-5-氯苯基环己基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-5-氯苯基环己基酮?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-5-氯苯基环己基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.