2-(氨甲基)-1,4-苯并二氧六环盐酸盐
TL;DR: 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 (CAS 1446-27-1) is a chemical compound with molecular formula C9H12ClNO2 and molecular weight 201.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(氨甲基)-1,4-苯并二氧六环盐酸盐
2,3-dihydro-1,4-benzodioxin-3-ylmethylazanium chloride
Also Known As: USAF EL-48, Pyrimidine-5-boronic acid, Iodonitrotetrazolium chloride, 2-(Aminomethyl)-1,4-benzodioxane hydrochloride, 2,3-dihydro-1,4-benzodioxin-3-ylmethylazanium;chloride
| Molecular Formula | C9H12ClNO2 |
|---|---|
| Molecular Weight | 201.06 g/mol |
| LogP | -2.93 |
| Topological Polar Surface Area | 46.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.05565 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 1446-27-1 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C[NH3+].[Cl-] |
| InChIKey | QIPSWJFYYUTYHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(氨甲基)-1,4-苯并二氧六环盐酸盐 (CAS 1446-27-1), with molecular formula C9H12ClNO2 and molecular weight 201.06 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxin-3-ylmethylazanium chloride.
Chemical Property Profile of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐
Property Insights of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐
The XLogP value of -2.93 indicates that 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.1 Ų, 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 has 1 hydrogen bond donor(s) and 3 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-(氨甲基)-1,4-苯并二氧六环盐酸盐?
The CAS number of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 is 1446-27-1.
What is the molecular formula of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐?
The molecular formula of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 is C9H12ClNO2.
What is the molecular weight of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐?
The molecular weight of 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 is 201.06 g/mol.
Where can I buy 2-(氨甲基)-1,4-苯并二氧六环盐酸盐?
You can request a quote for 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(氨甲基)-1,4-苯并二氧六环盐酸盐?
Yes, KEHONG BIO provides custom synthesis services for 2-(氨甲基)-1,4-苯并二氧六环盐酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.