苯乙烷-d4-胺
TL;DR: 苯乙烷-d4-胺 (CAS 87620-08-4) is a chemical compound with molecular formula C8H11N and molecular weight 125.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯乙烷-d4-胺
1,1,2,2-tetradeuterio-2-phenylethanamine
Also Known As: Benzeneethan-d4-amine, Phenethylamine-d4, 2-Phenylethylamine-d4, 2-Phenylethylamine-[d4], tetra-deuterophenylethylamine
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 125.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.11426 |
| Heavy Atoms | 9 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 87620-08-4 |
|---|---|
| SMILES | [2H]C([2H])(C1=CC=CC=C1)C([2H])([2H])N |
| InChIKey | BHHGXPLMPWCGHP-KXGHAPEVSA-N |
Product Overview
苯乙烷-d4-胺 (CAS 87620-08-4), with molecular formula C8H11N and molecular weight 125.11 g/mol. IUPAC: 1,1,2,2-tetradeuterio-2-phenylethanamine.
Chemical Property Profile of 苯乙烷-d4-胺
Property Insights of 苯乙烷-d4-胺
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯乙烷-d4-胺. With a topological polar surface area (TPSA) of 26.0 Ų, 苯乙烷-d4-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯乙烷-d4-胺 has 1 hydrogen bond donor(s) and 1 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 苯乙烷-d4-胺?
The CAS number of 苯乙烷-d4-胺 is 87620-08-4.
What is the molecular formula of 苯乙烷-d4-胺?
The molecular formula of 苯乙烷-d4-胺 is C8H11N.
What is the molecular weight of 苯乙烷-d4-胺?
The molecular weight of 苯乙烷-d4-胺 is 125.11 g/mol.
Where can I buy 苯乙烷-d4-胺?
You can request a quote for 苯乙烷-d4-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯乙烷-d4-胺?
Yes, KEHONG BIO provides custom synthesis services for 苯乙烷-d4-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.