Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride
TL;DR: Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride (CAS 13210-08-7) is a chemical compound with molecular formula C23H29Cl2NO3 and molecular weight 437.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[di(propan-2-yl)amino]ethyl 2-(4-chloro-9H-xanthen-9-yl)acetate;hydrochloride
Also Known As: 2-(Diisopropylamino)ethyl xanthene-9-acetate hydrochloride, 2-Diisopropylaminoethyl 9-xanthenylacetate hydrochloride, Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride, 2-[Di(propan-2-yl)amino]ethyl (4-chloro-9H-xanthen-9-yl)acetate--hydrogen chloride (1/1), 2-[di(propan-2-yl)amino]ethyl 2-(4-chloro-9H-xanthen-9-yl)acetate hydrochloride
| Molecular Formula | C23H29Cl2NO3 |
|---|---|
| Molecular Weight | 437.15 g/mol |
| LogP | 6.0515 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.15244 |
| Heavy Atoms | 29 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 13210-08-7 |
|---|---|
| SMILES | CC(C)N(CCOC(=O)CC1C2=C(C(=CC=C2)Cl)OC3=CC=CC=C13)C(C)C.Cl |
| InChIKey | PGFNRTPGANCMKK-UHFFFAOYSA-N |
Product Overview
Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride (CAS 13210-08-7), with molecular formula C23H29Cl2NO3 and molecular weight 437.15 g/mol. IUPAC: 2-[di(propan-2-yl)amino]ethyl 2-(4-chloro-9H-xanthen-9-yl)acetate;hydrochloride.
Chemical Property Profile of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride
Property Insights of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride
The XLogP value of 6.0515 indicates that Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride has 1 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 Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride?
The CAS number of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride is 13210-08-7.
What is the molecular formula of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride?
The molecular formula of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride is C23H29Cl2NO3.
What is the molecular weight of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride?
The molecular weight of Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride is 437.15 g/mol.
Where can I buy Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride?
You can request a quote for Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Xanthene-9-acetic acid, 2-(diisopropylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.