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Home > Encyclopedia > 1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE

1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE

1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE structure

1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE 

structure
  • CAS No:

    704-48-3

  • Formula:

    C9H9NO2

  • Chemical Name:

    1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE

  • Synonyms:

    2,3-dihydro-1,5-benzoxazepin-4(5h)-one;1,3,4,5-Tetrahydro-5-oxa-benzo[b]azepin-2-one;1,5-Benzoxazepin-4(5H)-one, 2,3-dihydro-;2,3-Dihydrobenzo[b][1,4]oxazepin-4(5H)-one;2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one;SCHEMBL1756086;CTK2G2989;DTXSID30514620;ZINC36378444;AKOS022468273

1,3,4,5-TETRAHYDRO-5-OXA-BENZO[B]AZEPIN-2-ONE Basic Attributes

163.17300

163.06300

DTXSID30514620

2934999090

Characteristics

41.82000

1.49270

1.186

128-129ºC

346ºC

163ºC

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|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:163.17
XLogP3:0.8
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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