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Home > Encyclopedia > 3,4-Hihydro-1,4-benzoxazepin-5(2H)-one

3,4-Hihydro-1,4-benzoxazepin-5(2H)-one

3,4-Hihydro-1,4-benzoxazepin-5(2H)-one structure

3,4-Hihydro-1,4-benzoxazepin-5(2H)-one 

structure
  • CAS No:

    703-51-5

  • Formula:

    C9H9NO2

  • Chemical Name:

    3,4-Hihydro-1,4-benzoxazepin-5(2H)-one

  • Synonyms:

    3,4-dihydro-2H-1,4-benzoxazepin-5-one;3,4-Hihydro-1,4-benzoxazepin-5(2H)-one;3,4-Dihydro-2H-benzo[f][1,4]oxazepin-5-one;3,4-dihydrobenzo[f][1,4]oxazepin-5(2H)-one;2-oxa-5-azabicyclo[5.4.0]undeca-7,9,11-trien-6-one

3,4-Hihydro-1,4-benzoxazepin-5(2H)-one Basic Attributes

163.17300

163.06300

371485

DTXSID60321187

2934999090

Characteristics

38.33000

1.13760

1.186g/cm3

115-116 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))

404.7ºC at 760 mmHg

198.6ºC

1.545

Safety Information

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:163.17
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:163.063328530
Monoisotopic Mass:163.063328530
Topological Polar Surface Area:38.3
Heavy Atom Count:12
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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