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Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)
TL;DR: Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) (CAS 67952-82-3) is a chemical compound with molecular formula C7H15N3O2 and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;3-(2-aminoethylamino)propanenitrile
Also Known As: (C5-H11-N3)x-.x-C2-H4-O2, acetic acid; 3-(2-aminoethylamino)propanenitrile, Acetic acid salt of propionitrile, 3-((2-aminoethyl)amino)polymers, Propionitrile, 3-((2-aminoethyl)amino), polymers, acetate, 3-((2-Aminoethyl)amino)propionitrile polymer, acetic acid salt
| Molecular Formula | C7H15N3O2 |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | -0.46072 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.11642 |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 67952-82-3 |
|---|---|
| SMILES | CC(=O)O.C(CNCCN)C#N |
| InChIKey | LAIWOFGLYROMFQ-UHFFFAOYSA-N |
Product Overview
Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) (CAS 67952-82-3), with molecular formula C7H15N3O2 and molecular weight 173.12 g/mol. IUPAC: acetic acid;3-(2-aminoethylamino)propanenitrile.
Chemical Property Profile of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)
Property Insights of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)
The XLogP value of -0.46072 indicates that Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1). Following Lipinski's Rule of Five, Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) has 3 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 Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)?
The CAS number of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) is 67952-82-3.
What is the molecular formula of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)?
The molecular formula of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) is C7H15N3O2.
What is the molecular weight of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)?
The molecular weight of Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) is 173.12 g/mol.
Where can I buy Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)?
You can request a quote for Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid--3-[(2-aminoethyl)amino]propanenitrile (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.