2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)
TL;DR: 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) (CAS 77791-55-0) is a chemical compound with molecular formula C12H18Cl2N2O and molecular weight 276.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl-[2-(2-chloroanilino)-2-oxoethyl]azanium chloride
Also Known As: 2-(Butylamino)-2'-chloroacetanilide, hydrochloride, ACETANILIDE, 2-(BUTYLAMINO)-2'-CHLORO-, HYDROCHLORIDE, butyl-[2-(2-chloroanilino)-2-oxoethyl]azanium chloride, butyl-[2-(2-chloroanilino)-2-oxoethyl]azanium,chloride, BUTYL-[(2-CHLOROPHENYL)CARBAMOYLMETHYL]AZANIUM CHLORIDE
| Molecular Formula | C12H18Cl2N2O |
|---|---|
| Molecular Weight | 276.08 g/mol |
| LogP | -1.35 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 276.07962 |
| Heavy Atoms | 17 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 77791-55-0 |
|---|---|
| SMILES | CCCC[NH2+]CC(=O)NC1=CC=CC=C1Cl.[Cl-] |
| InChIKey | WXUBXPWWNAFOAC-UHFFFAOYSA-N |
Product Overview
2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) (CAS 77791-55-0), with molecular formula C12H18Cl2N2O and molecular weight 276.08 g/mol. IUPAC: butyl-[2-(2-chloroanilino)-2-oxoethyl]azanium chloride.
Chemical Property Profile of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)
Property Insights of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)
The XLogP value of -1.35 indicates that 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.7 Ų, 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (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 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)?
The CAS number of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) is 77791-55-0.
What is the molecular formula of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)?
The molecular formula of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) is C12H18Cl2N2O.
What is the molecular weight of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)?
The molecular weight of 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) is 276.08 g/mol.
Where can I buy 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)?
You can request a quote for 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.