1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride
TL;DR: 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride (CAS 3998-94-5) is a chemical compound with molecular formula C12H21ClN2 and molecular weight 228.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,2-N,2-trimethyl-1-phenylpropane-1,2-diamine;hydrochloride
Also Known As: N,N,1,1-Tetramethyl-2-phenylethylenediamine, 1,2-(N,N-Dimethyl)diamino-2-methyl-1-phenylpropane, hydrochloride, 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride, N(2),N(2),2-Trimethyl-1-phenyl-1,2-propanediamine monohydrochloride, 2-N,2-N,2-trimethyl-1-phenylpropane-1,2-diamine hydrochloride
| Molecular Formula | C12H21ClN2 |
|---|---|
| Molecular Weight | 228.14 g/mol |
| LogP | 2.4484 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.13933 |
| Heavy Atoms | 15 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 3998-94-5 |
|---|---|
| SMILES | CC(C)(C(C1=CC=CC=C1)N)N(C)C.Cl |
| InChIKey | GWCHKCZEVNDHSW-UHFFFAOYSA-N |
Product Overview
1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride (CAS 3998-94-5), with molecular formula C12H21ClN2 and molecular weight 228.14 g/mol. IUPAC: 2-N,2-N,2-trimethyl-1-phenylpropane-1,2-diamine;hydrochloride.
Chemical Property Profile of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride
Property Insights of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride
The XLogP value of 2.4484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride. With a topological polar surface area (TPSA) of 29.3 Ų, 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride 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
Frequently Asked Questions
What is the CAS number of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride?
The CAS number of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride is 3998-94-5.
What is the molecular formula of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride?
The molecular formula of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride is C12H21ClN2.
What is the molecular weight of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride?
The molecular weight of 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride is 228.14 g/mol.
Where can I buy 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride?
You can request a quote for 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediamine, 1-phenyl-N(sup 1),N(sup 2),2-trimethyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.