Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)
TL;DR: Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) (CAS 25808-30-4) is a chemical compound with molecular formula C3H7ClN2 and molecular weight 106.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methylamino)acetonitrile;hydrochloride
Also Known As: Methylaminoacetonitrile hydrochloride, 2-(methylamino)acetonitrile hydrochloride, Cyanomethyl(methyl)ammonium chloride, Sarcosinenitrile hydrochloride, 2-(methylamino)acetonitrile
| Molecular Formula | C3H7ClN2 |
|---|---|
| Molecular Weight | 106.03 g/mol |
| LogP | 0.15 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 106.02978 |
| Heavy Atoms | 6 |
| Complexity | 49.0 |
Chemical Identifiers
| CAS Number | 25808-30-4 |
|---|---|
| SMILES | CNCC#N.Cl |
| InChIKey | DFKBQHBEROHUNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) (CAS 25808-30-4), with molecular formula C3H7ClN2 and molecular weight 106.03 g/mol. IUPAC: 2-(methylamino)acetonitrile;hydrochloride.
Chemical Property Profile of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)
Property Insights of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)
The XLogP value of 0.15 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetonitrile, 2-(methylamino)-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 35.8 Ų, Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) 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 Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)?
The CAS number of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) is 25808-30-4.
What is the molecular formula of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)?
The molecular formula of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) is C3H7ClN2.
What is the molecular weight of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)?
The molecular weight of Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) is 106.03 g/mol.
Where can I buy Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)?
You can request a quote for Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile, 2-(methylamino)-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile, 2-(methylamino)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.