Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride
TL;DR: Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride (CAS 73663-79-3) is a chemical compound with molecular formula C9H19ClN2 and molecular weight 190.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyanomethyl(2,4-dimethylpentan-2-yl)azanium chloride
Also Known As: (1,1,3-Trimethylbutylamino)acetonitrile hydrochloride, ACETONITRILE, (1,1,3-TRIMETHYLBUTYLAMINO)-, HYDROCHLORIDE, cyanomethyl(2,4-dimethylpentan-2-yl)azanium chloride, Acetonitrile, [(1,1,3-trimethylbutyl)amino]-, monohydrochloride, RefChem:316832
| Molecular Formula | C9H19ClN2 |
|---|---|
| Molecular Weight | 190.12 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 40.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.12367 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 73663-79-3 |
|---|---|
| SMILES | CC(C)CC(C)(C)[NH2+]CC#N.[Cl-] |
| InChIKey | SUOVFOBMRZHDKY-UHFFFAOYSA-N |
Product Overview
Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride (CAS 73663-79-3), with molecular formula C9H19ClN2 and molecular weight 190.12 g/mol. IUPAC: cyanomethyl(2,4-dimethylpentan-2-yl)azanium chloride.
Chemical Property Profile of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride
Property Insights of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride
The XLogP value of -2.1 indicates that Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.4 Ų, Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride has 1 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, (1,1,3-trimethylbutylamino)-, hydrochloride?
The CAS number of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride is 73663-79-3.
What is the molecular formula of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride?
The molecular formula of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride is C9H19ClN2.
What is the molecular weight of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride?
The molecular weight of Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride is 190.12 g/mol.
Where can I buy Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride?
You can request a quote for Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile, (1,1,3-trimethylbutylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.