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Home > Encyclopedia > 7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one structure

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one 

structure
  • CAS No:

    3993-46-2

  • Formula:

    C16H16Br2O4

  • Chemical Name:

    7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

  • Synonyms:

    2H-1-Benzopyran-2-one,7-(acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-;Coumarin,6-(2,3-dibromopropyl)-7-hydroxy-4,8-dimethyl-,acetate;Umbelliferone,6-(2,3-dibromopropyl)-4,8-dimethyl-,acetate;7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one Basic Attributes

432.1

432.10

2932209090

Characteristics

52.6

4.03600

1.63g/cm3

141.5-142.5 °C

496.5ºC at 760mmHg

254.1ºC

1.596

Safety Information

NONH for all modes of transport

3

36/37/38

26-37/39

Xi

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one Use and Manufacturing

2H-1-Benzopyran-2-one, 7-(acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-: INACTIVE

Computed Properties

Molecular Weight:432.10
XLogP3:3.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:431.93948
Monoisotopic Mass:429.94153
Topological Polar Surface Area:52.6
Heavy Atom Count:22
Complexity:477
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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