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Home > Encyclopedia > (2,4,6-tribromophenyl) hexanoate

(2,4,6-tribromophenyl) hexanoate

(2,4,6-tribromophenyl) hexanoate structure

(2,4,6-tribromophenyl) hexanoate 

structure
  • CAS No:

    16732-09-5

  • Formula:

    C12H13Br3O2

  • Chemical Name:

    (2,4,6-tribromophenyl) hexanoate

  • Synonyms:

    Hexanoic Acid 2,4,6-Tribromophenyl Ester; 2,4,6-Tribromophenyl hexanoate; WKADNUIXFNFRSW-UHFFFAOYSA; 2,4,6-Tribromphenol-caproat;

  • Categories:

    Pharmaceutical Intermediates  >  Ophthalmic Agents

(2,4,6-tribromophenyl) hexanoate Basic Attributes

428.94200

427.84452 g/mol

DTXSID10340762

2915900090

Characteristics

26.30000

5.45980

1.77

400.1ºC at 760 mmHg

195.8ºC

1.569

1.31E-06mmHg at 25°C

Safety Information

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P313, P337+P313, P362, P370+P378, P403+P235, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:428.94
XLogP3:5.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:427.84452
Monoisotopic Mass:425.84657
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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