Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-
TL;DR: Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- (CAS 55901-79-6) is a chemical compound with molecular formula C13H10Cl2O3S and molecular weight 315.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,3-dichloro-4-(thiophen-2-ylmethyl)phenoxy]acetic acid
Also Known As: [2,3-Dichloro-4- phenoxy]aceticacid|(2,3-Dichloro-4-(2-thienylmethyl)phenoxy)acetic acid|ACETIC ACID, (2,3-DICHLORO-4-(2-THIENYLMETHYL)PHENOXY)-|[2,3-dichloro-4-(2-thienylmethyl)phenoxy]acetic acid|Acetic acid, [2,3-dichloro-4-(2-thienylmethyl)phenoxy]-|{2,3-Dichloro-4-[(thiophen-2-yl)methyl]phenoxy}acetic acid|2-[2,3-dichloro-4-(thiophen-2-ylmethyl)phenoxy]acetic acid|2-{2,3-dichloro-4-[(thiophen-2-yl)methyl]phenoxy}acetic acid|BRN 1591300|RefChem:316109|DTXCID40126990
| Molecular Formula | C13H10Cl2O3S |
|---|---|
| Molecular Weight | 315.97 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.97278 |
| Heavy Atoms | 19 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 55901-79-6 |
|---|---|
| SMILES | C1=CSC(=C1)CC2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl |
| InChIKey | CAANODYIPBBLNZ-UHFFFAOYSA-N |
Product Overview
Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- (CAS 55901-79-6), with molecular formula C13H10Cl2O3S and molecular weight 315.97 g/mol. IUPAC: 2-[2,3-dichloro-4-(thiophen-2-ylmethyl)phenoxy]acetic acid.
Chemical Property Profile of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-
Property Insights of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-
The XLogP value of 4.4 indicates that Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-. Following Lipinski's Rule of Five, Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- has 1 hydrogen bond donor(s) and 4 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 Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-?
The CAS number of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- is 55901-79-6.
What is the molecular formula of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-?
The molecular formula of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- is C13H10Cl2O3S.
What is the molecular weight of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-?
The molecular weight of Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- is 315.97 g/mol.
Where can I buy Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-?
You can request a quote for Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2,3-dichloro-4-(2-thienylmethyl)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.