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chlorotyrosine structure
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chlorotyrosine

TL;DR: chlorotyrosine (CAS 144978-56-3) is a chemical compound with molecular formula C9H10ClNO3 and molecular weight 215.03493 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-(chloroamino)-3-(4-hydroxyphenyl)propanoic acid

Also Known As: chlorotyrosine, 2-(chloroamino)-3-(4-hydroxyphenyl)propanoic acid, (2S)-2-(chloroamino)-3-(4-hydroxyphenyl)propanoic Acid

CAS Number
144978-56-3
Molecular Formula
C9H10ClNO3
Molecular Weight
215.03493 g/mol
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Technical Specifications

Molecular FormulaC9H10ClNO3
Molecular Weight215.03493 g/mol
XLogP-1.0
Topological Polar Surface Area (TPSA)69.6 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass215.03493 Da
Heavy Atoms14
Complexity192.0
SMILESC1=CC(=CC=C1C[C@@H](C(=O)O)NCl)O
InChIKeyHKDIYFPRGVYHOI-QMMMGPOBSA-N

Chemical Property Profile of chlorotyrosine

XLogP
-1.0
TPSA (Topological Polar Surface Area)
69.6
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
14
Complexity
192.0
Exact Mass
215.03493
Monoisotopic Mass
215.03493
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of chlorotyrosine

The XLogP value of -1.0 indicates that chlorotyrosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for chlorotyrosine. Following Lipinski's Rule of Five, chlorotyrosine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of chlorotyrosine?

The CAS number of chlorotyrosine is 144978-56-3.

What is the molecular formula of chlorotyrosine?

The molecular formula of chlorotyrosine is C9H10ClNO3.

What is the molecular weight of chlorotyrosine?

The molecular weight of chlorotyrosine is 215.03493 g/mol.

Where can I buy chlorotyrosine?

You can request a quote for chlorotyrosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for chlorotyrosine?

Yes, CoreyChem provides custom synthesis services for chlorotyrosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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