Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine
TL;DR: Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine (CAS 99375-96-9) is a chemical compound with molecular formula C13H26N4O and molecular weight 254.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;2-methylphenol
Also Known As: Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine, Methylphenol compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine, N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine; 2-methylphenol, N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;2-methylphenol, 2-Methylphenol--N~1~,N~1'~-(ethane-1,2-diyl)di(ethane-1,2-diamine) (1/1)
| Molecular Formula | C13H26N4O |
|---|---|
| Molecular Weight | 254.21 g/mol |
| LogP | -0.21638 |
| Topological Polar Surface Area | 96.33 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 254.21066 |
| Heavy Atoms | 18 |
| Complexity | 265.07468 |
Chemical Identifiers
| CAS Number | 99375-96-9 |
|---|---|
| SMILES | CC1=CC=CC=C1O.C(CNCCNCCN)N |
Product Overview
Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine (CAS 99375-96-9), with molecular formula C13H26N4O and molecular weight 254.21 g/mol. IUPAC: N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;2-methylphenol.
Chemical Property Profile of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine
Property Insights of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine
The XLogP value of -0.21638 indicates that Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.33 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine. Following Lipinski's Rule of Five, Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine has 5 hydrogen bond donor(s) and 5 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 Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine?
The CAS number of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine is 99375-96-9.
What is the molecular formula of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine?
The molecular formula of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine is C13H26N4O.
What is the molecular weight of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine?
The molecular weight of Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine is 254.21 g/mol.
Where can I buy Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine?
You can request a quote for Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine?
Yes, KEHONG BIO provides custom synthesis services for Phenol, methyl-, compd. with N,N'-bis(2-aminoethyl)-1,2-ethanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.