![2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] structure](/static/products/5359/53596-32-0.webp)
2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]
TL;DR: 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] (CAS 53596-32-0) is a chemical compound with molecular formula C17H14ClN2O2P and molecular weight 344.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-3-methylphenoxy)-2,4-diaza-3λ5-phosphatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene 3-oxide
Also Known As: 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de], 2-(4-Chloro-3-methylphenoxy)-2,3-dihydro(1H)naphtho[1,8-de]-1,3,2-diazaphosphorine 2-oxide, 2-(4-Chloro-3-methylphenoxy)-2,3-dihydro-1H-2lambda~5~-naphtho[1,8-de][1,3,2]diazaphosphinin-2-one, 2-(4-Chloro-3-methylphenoxy)-2,3-dihydro-1H-naphtho(1,8-de)-1,3,2-diazaphosphorine 2-oxide, 2-(4-Chloro-3-methylphenoxy)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaphosphinine 2-oxide #
| Molecular Formula | C17H14ClN2O2P |
|---|---|
| Molecular Weight | 344.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.04816 |
| Heavy Atoms | 23 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 53596-32-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OP2(=O)NC3=CC=CC4=C3C(=CC=C4)N2)Cl |
| InChIKey | PHVANJRDFRMFSL-UHFFFAOYSA-N |
Product Overview
2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] (CAS 53596-32-0), with molecular formula C17H14ClN2O2P and molecular weight 344.05 g/mol. IUPAC: 3-(4-chloro-3-methylphenoxy)-2,4-diaza-3λ5-phosphatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene 3-oxide.
Chemical Property Profile of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]
Property Insights of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]
The XLogP value of 5.3 indicates that 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]?
The CAS number of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] is 53596-32-0.
What is the molecular formula of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]?
The molecular formula of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] is C17H14ClN2O2P.
What is the molecular weight of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]?
The molecular weight of 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] is 344.05 g/mol.
Where can I buy 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]?
You can request a quote for 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de]?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chloro-3-methyl-phenoxy)-2,3-dihydro-1H-naphtho[1,8-de] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.