Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride
TL;DR: Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride (CAS 100700-18-3) is a chemical compound with molecular formula C8H17Cl3N2O and molecular weight 262.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-amino-1-oxobutan-2-yl)-bis(2-chloroethyl)azanium chloride
Also Known As: 2-(Bis(2-chloroethyl)amino)butyramide monohydrochloride, BUTYRAMIDE, 2-(BIS(2-CHLOROETHYL)AMINO)-, MONOHYDROCHLORIDE, (1-amino-1-oxobutan-2-yl)-bis(2-chloroethyl)azanium chloride, (1-amino-1-oxobutan-2-yl)-bis(2-chloroethyl)azanium, 1-amino-n,n-bis(2-chloroethyl)-1-oxobutan-2-aminium chloride
| Molecular Formula | C8H17Cl3N2O |
|---|---|
| Molecular Weight | 262.04 g/mol |
| LogP | -3.38 |
| Topological Polar Surface Area | 47.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.04065 |
| Heavy Atoms | 14 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 100700-18-3 |
|---|---|
| SMILES | CCC(C(=O)N)[NH+](CCCl)CCCl.[Cl-] |
| InChIKey | WLDDAMAQNUDKSY-UHFFFAOYSA-N |
Product Overview
Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride (CAS 100700-18-3), with molecular formula C8H17Cl3N2O and molecular weight 262.04 g/mol. IUPAC: (1-amino-1-oxobutan-2-yl)-bis(2-chloroethyl)azanium chloride.
Chemical Property Profile of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride
Property Insights of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride
The XLogP value of -3.38 indicates that Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.5 Ų, Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyramide, 2-(bis(2-chloroethyl)amino)-, 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 Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride?
The CAS number of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride is 100700-18-3.
What is the molecular formula of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride?
The molecular formula of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride is C8H17Cl3N2O.
What is the molecular weight of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride?
The molecular weight of Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride is 262.04 g/mol.
Where can I buy Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride?
You can request a quote for Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.