Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate
TL;DR: Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate (CAS 55593-07-2) is a chemical compound with molecular formula C23H16Cl5NO5 and molecular weight 560.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentachlorophenyl) (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: EINECS 259-720-0, Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate, pentachlorophenyl N-[(benzyloxy)carbonyl]-L-tyrosinate, N-[(Phenylmethoxy)carbonyl]-L-tyrosine pentachlorophenyl ester, (2,3,4,5,6-pentachlorophenyl) (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate
| Molecular Formula | C23H16Cl5NO5 |
|---|---|
| Molecular Weight | 560.95 g/mol |
| LogP | 7.1023 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 560.9471 |
| Heavy Atoms | 34 |
| Complexity | 1159.6003 |
Chemical Identifiers
| CAS Number | 55593-07-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)OC3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)Cl |
Product Overview
Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate (CAS 55593-07-2), with molecular formula C23H16Cl5NO5 and molecular weight 560.95 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate
Property Insights of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate
The XLogP value of 7.1023 indicates that Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate. Following Lipinski's Rule of Five, Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate?
The CAS number of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate is 55593-07-2.
What is the molecular formula of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate?
The molecular formula of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate is C23H16Cl5NO5.
What is the molecular weight of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate?
The molecular weight of Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate is 560.95 g/mol.
Where can I buy Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate?
You can request a quote for Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate?
Yes, KEHONG BIO provides custom synthesis services for Pentachlorophenyl N-((benzyloxy)carbonyl)-L-tyrosinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.