C9H8Cl3NO.ClH
TL;DR: C9H8Cl3NO.ClH (CAS 33357-29-8) is a chemical compound with molecular formula C9H9Cl4NO and molecular weight 286.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,5,7-trichloro-2,3-dihydro-1-benzofuran-2-yl)methylazanium chloride
Also Known As: 2,3-Dihydro-4,5,7-trichloro-2-benzofuranmethylamine hydrochloride, (4,5,7-trichloro-2,3-dihydro-1-benzofuran-2-yl)methylazanium chloride, 2-BENZOFURANMETHYLAMINE, 2,3-DIHYDRO-4,5,7-TRICHLORO-, HYDROCHLORIDE, 1-(4,5,7-Trichloro-2,3-dihydro-1-benzofuran-2-yl)methanamine--hydrogen chloride (1/1), RefChem:1054231
| Molecular Formula | C9H9Cl4NO |
|---|---|
| Molecular Weight | 286.94 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.9409 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 33357-29-8 |
|---|---|
| SMILES | C1C(OC2=C1C(=C(C=C2Cl)Cl)Cl)C[NH3+].[Cl-] |
| InChIKey | JJRYDBCZRWOMKF-UHFFFAOYSA-N |
Product Overview
C9H8Cl3NO.ClH (CAS 33357-29-8), with molecular formula C9H9Cl4NO and molecular weight 286.94 g/mol. IUPAC: (4,5,7-trichloro-2,3-dihydro-1-benzofuran-2-yl)methylazanium chloride.
Chemical Property Profile of C9H8Cl3NO.ClH
Property Insights of C9H8Cl3NO.ClH
The XLogP value of -0.8 indicates that C9H8Cl3NO.ClH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.9 Ų, C9H8Cl3NO.ClH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C9H8Cl3NO.ClH 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 C9H8Cl3NO.ClH?
The CAS number of C9H8Cl3NO.ClH is 33357-29-8.
What is the molecular formula of C9H8Cl3NO.ClH?
The molecular formula of C9H8Cl3NO.ClH is C9H9Cl4NO.
What is the molecular weight of C9H8Cl3NO.ClH?
The molecular weight of C9H8Cl3NO.ClH is 286.94 g/mol.
Where can I buy C9H8Cl3NO.ClH?
You can request a quote for C9H8Cl3NO.ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C9H8Cl3NO.ClH?
Yes, KEHONG BIO provides custom synthesis services for C9H8Cl3NO.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.