2-(4-氨基-2-氯苯基)-2-苯基丙腈
TL;DR: 2-(4-氨基-2-氯苯基)-2-苯基丙腈 (CAS 38426-11-8) is a chemical compound with molecular formula C15H13ClN2 and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-氨基-2-氯苯基)-2-苯基丙腈
2-(4-amino-2-chlorophenyl)-2-phenylpropanenitrile
Also Known As: 2-(4-amino-2-chlorophenyl)-2-phenylpropanenitrile, 4-Amino-2-chloro-alpha-methyl-alpha-phenylbenzeneacetonitrile, Benzeneacetonitrile, 4-amino-2-chloro-alpha-methyl-alpha-phenyl-, 1,7-Naphthalenedisulfonic acid,4-diazo-3,4-dihydro-3-oxo, RefChem:1061162
| Molecular Formula | C15H13ClN2 |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.07672 |
| Heavy Atoms | 18 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 38426-11-8 |
|---|---|
| SMILES | CC(C#N)(C1=CC=CC=C1)C2=C(C=C(C=C2)N)Cl |
| InChIKey | CRLLILZMYVHZAQ-UHFFFAOYSA-N |
Product Overview
2-(4-氨基-2-氯苯基)-2-苯基丙腈 (CAS 38426-11-8), with molecular formula C15H13ClN2 and molecular weight 256.08 g/mol. IUPAC: 2-(4-amino-2-chlorophenyl)-2-phenylpropanenitrile.
Chemical Property Profile of 2-(4-氨基-2-氯苯基)-2-苯基丙腈
Property Insights of 2-(4-氨基-2-氯苯基)-2-苯基丙腈
The XLogP value of 3.6 indicates that 2-(4-氨基-2-氯苯基)-2-苯基丙腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 2-(4-氨基-2-氯苯基)-2-苯基丙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-氨基-2-氯苯基)-2-苯基丙腈 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-(4-氨基-2-氯苯基)-2-苯基丙腈?
The CAS number of 2-(4-氨基-2-氯苯基)-2-苯基丙腈 is 38426-11-8.
What is the molecular formula of 2-(4-氨基-2-氯苯基)-2-苯基丙腈?
The molecular formula of 2-(4-氨基-2-氯苯基)-2-苯基丙腈 is C15H13ClN2.
What is the molecular weight of 2-(4-氨基-2-氯苯基)-2-苯基丙腈?
The molecular weight of 2-(4-氨基-2-氯苯基)-2-苯基丙腈 is 256.08 g/mol.
Where can I buy 2-(4-氨基-2-氯苯基)-2-苯基丙腈?
You can request a quote for 2-(4-氨基-2-氯苯基)-2-苯基丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-氨基-2-氯苯基)-2-苯基丙腈?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-氨基-2-氯苯基)-2-苯基丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.