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  • Propanoic acid,2-(3-chlorophenoxy)-, sodium salt (1:1)
Name:Propanoic acid,2-(3-chlorophenoxy)-, sodium salt (1:1)
CAS No:53404-22-1

PRODUCT DESCRIPTION

【Name】
Propanoic acid,2-(3-chlorophenoxy)-, sodium salt (1:1)
【Iupac name】
sodium 2-(3-chlorophenoxy)propanoate
【CAS Registry number】
53404-22-1
【Synonyms】
Propanoicacid, 2-(3-chlorophenoxy)-, sodium salt (9CI)
Propionic acid,2-[m-chlorophenoxy]-, sodium salts (5CI)
2-(3-Chlorophenoxy)propanoic acidsodium salt
Sodium 2-(3-chlorophenoxy)propanoate
【Molecular Formula】
C9H8ClNaO3 (Products with the same molecular formula)
【Molecular Weight】
222.60
【Inchi】
InChI=1/C9H9ClO3.Na/c1-6(9(11)12)13-8-4-2-3-7(10)5-8;/h2-6H,1H3,(H,11,12);/q;+1/p-1
【Canonical SMILES】
CC(C(=O)[O-])OC1=CC(=CC=C1)Cl.[Na+]
【MOL File】
53404-22-1.mol

Chemical and Physical Properties

【Density】
g/cm3
【Boiling Point】
318.5°Cat760mmHg
【Flash Point】
146.4°C
【Computed Properties】
Molecular Weight:222.60079 [g/mol]
Molecular Formula:C9H8ClNaO3
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:222.005967
MonoIsotopic Mass:222.005967
Topological Polar Surface Area:49.4
Heavy Atom Count:14
Formal Charge:0
Complexity:189
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2

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