2-Phenylbutane-1,2-diamine
TL;DR: 2-Phenylbutane-1,2-diamine (CAS 5062-64-6) is a chemical compound with molecular formula C10H16N2 and molecular weight 164.13135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylbutane-1,2-diamine
Also Known As: 2-Phenyl-1,2-butanediamine, 2-phenylbutane-1,2-diamine, Phenyl-2 butanediamine-1,2, 1,2-Diaminobutane, 2-phenyl-, 1,2-BUTANEDIAMINE, 2-PHENYL-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.13135 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.13135 Da |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| SMILES | CCC(CN)(C1=CC=CC=C1)N |
| InChIKey | CBBWBITZUIWDJB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Phenylbutane-1,2-diamine
Property Insights of 2-Phenylbutane-1,2-diamine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylbutane-1,2-diamine. With a topological polar surface area (TPSA) of 52.0 Ų, 2-Phenylbutane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylbutane-1,2-diamine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Phenylbutane-1,2-diamine?
The CAS number of 2-Phenylbutane-1,2-diamine is 5062-64-6.
What is the molecular formula of 2-Phenylbutane-1,2-diamine?
The molecular formula of 2-Phenylbutane-1,2-diamine is C10H16N2.
What is the molecular weight of 2-Phenylbutane-1,2-diamine?
The molecular weight of 2-Phenylbutane-1,2-diamine is 164.13135 g/mol.
Where can I buy 2-Phenylbutane-1,2-diamine?
You can request a quote for 2-Phenylbutane-1,2-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Phenylbutane-1,2-diamine?
Yes, CoreyChem provides custom synthesis services for 2-Phenylbutane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.