(2-CHLORO-PHENOXY)-...

(2-CHLORO-PHENOXY)-ACETIC ACID ETHYL ESTER 52094-97-0

(2-CHLORO-PHENOXY)-ACETIC ACID ETHYL ESTER 52094-97-0

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Acetic acid,2-(2-chlorophenoxy)-, ethyl ester (2-CHLORO-PHENOXY)-ACETIC ACID ETHYL ESTER 52094-97-0

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  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:Room Temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
Acetic acid,2-(2-chlorophenoxy)-, ethyl ester
【Iupac name】
ethyl 2-(2-chlorophenoxy)acetate
【CAS Registry number】
52094-97-0
【Synonyms】
Aceticacid, (2-chlorophenoxy)-, ethyl ester (9CI)
Acetic acid, (o-chlorophenoxy)-,ethyl ester (6CI,7CI)
(2-Chlorophenoxy)acetic Acid Ethyl Ester
Ethyl(o-chlorophenoxy)acetate
Ethyl 2-chlorophenoxyacetate
NSC 190550
【Molecular Formula】
C10H11 Cl O3 (Products with the same molecular formula)
【Molecular Weight】
214.6455
【Inchi】
InChI=1/C10H11ClO3/c1-2-13-10(12)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3
【Canonical SMILES】
CCOC(=O)COC1=CC=CC=C1Cl
【MOL File】
52094-97-0.mol
Chemical and Physical Properties
【Density】
1.203g/cm3
【Boiling Point】
281.3°Cat760mmHg
【Refractive Index】
1.511
【Flash Point】
113.6°C
【Computed Properties】
Molecular Weight:214.64554 [g/mol]
Molecular Formula:C10H11ClO3
XLogP3:2.6
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:5
Exact Mass:214.039672
MonoIsotopic Mass:214.039672
Topological Polar Surface Area:35.5
Heavy Atom Count:14
Formal Charge:0
Complexity:184
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Ring Count:1
Effective Rotor Count:5
Conformer Sampling RMSD:0.6
CID Conformer Count:229

 

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