Phentyrin

2-amino-3-[4-[4-[bis(2-chloroethyl)amino]phenoxy]phenyl]propanoic acid

CAS: 857-95-4

Molecular Formula	`C19H22Cl2N2O3`
Molecular Weight	397.3 g/mol
LogP	1.0
Topological Polar Surface Area	75.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	10
Exact Mass	396.10074
Heavy Atoms	26
Complexity	406.0

Chemical Identifiers

CAS Number	857-95-4
SMILES	`C1=CC(=CC=C1CC(C(=O)O)N)OC2=CC=C(C=C2)N(CCCl)CCCl`
InChIKey	`IDJLCKJFVNGXOP-UHFFFAOYSA-N`

📖 Product Overview

Phentyrin (CAS: 857-95-4) is a chemical compound with molecular formula C19H22Cl2N2O3 and molecular weight 397.3 g/mol. Its IUPAC systematic name is 2-amino-3-[4-[4-[bis(2-chloroethyl)amino]phenoxy]phenyl]propanoic acid. LogP 1.0 Topological Polar Surface Area 75.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 10 Exact Mass 396.10074 Heavy Atoms 26 Complexity 406.0 InChI Key: IDJLCKJFVNGXOP-UHFFFAOYSA-N. SMILES: C1=CC(=CC=C1CC(C(=O)O)N)OC2=CC=C(C=C2)N(CCCl)CCCl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Frequently Asked Questions

What is the typical lead time for this product?

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Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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