α,β-二甲基苯乙胺
TL;DR: α,β-二甲基苯乙胺 (CAS 2499-51-6) is a chemical compound with molecular formula C10H15N and molecular weight 149.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
α,β-二甲基苯乙胺
3-phenylbutan-2-amine
Also Known As: 3-phenylbutan-2-amine, 3-phenyl-2-amino butane, 2-Amino-3-phenylbutan, 1-Fenylo-1-metylo-aminopropan, 2-PHENYL-3-AMINOBUTANE
| Molecular Formula | C10H15N |
|---|---|
| Molecular Weight | 149.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 149.12045 |
| Heavy Atoms | 11 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 2499-51-6 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)C(C)N |
| InChIKey | BKRHEVJTTWAYFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
α,β-二甲基苯乙胺 (CAS 2499-51-6), with molecular formula C10H15N and molecular weight 149.12 g/mol. IUPAC: 3-phenylbutan-2-amine.
Chemical Property Profile of α,β-二甲基苯乙胺
Property Insights of α,β-二甲基苯乙胺
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for α,β-二甲基苯乙胺. With a topological polar surface area (TPSA) of 26.0 Ų, α,β-二甲基苯乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, α,β-二甲基苯乙胺 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 α,β-二甲基苯乙胺?
The CAS number of α,β-二甲基苯乙胺 is 2499-51-6.
What is the molecular formula of α,β-二甲基苯乙胺?
The molecular formula of α,β-二甲基苯乙胺 is C10H15N.
What is the molecular weight of α,β-二甲基苯乙胺?
The molecular weight of α,β-二甲基苯乙胺 is 149.12 g/mol.
Where can I buy α,β-二甲基苯乙胺?
You can request a quote for α,β-二甲基苯乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for α,β-二甲基苯乙胺?
Yes, KEHONG BIO provides custom synthesis services for α,β-二甲基苯乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.