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Home > Encyclopedia > 5-Chloro-7-nitro-2(3H)-benzoxazolone

5-Chloro-7-nitro-2(3H)-benzoxazolone

5-Chloro-7-nitro-2(3H)-benzoxazolone structure

5-Chloro-7-nitro-2(3H)-benzoxazolone 

structure
  • CAS No:

    811810-67-0

  • Formula:

    C7H3ClN2O4

  • Chemical Name:

    5-Chloro-7-nitro-2(3H)-benzoxazolone

  • Synonyms:

    2(3H)-Benzoxazolone,5-chloro-7-nitro-;5-Chloro-7-nitro-2(3H)-benzoxazolone;5-Chloro-7-nitrobenzo[d]oxazol-2(3H)-one

Description

Off-White Solid

5-Chloro-7-nitro-2(3H)-benzoxazolone Basic Attributes

214.56272

214.56

DTXSID10652519

2934999090

Characteristics

84.2

2.20590

1.704g/cm3

1.646

Safety Information

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

5-Chloro-7-nitro-2(3H)-benzoxazolone Use and Manufacturing

An intermediate in the synthesis of Bifeprunox, which is used as an antipsychotic compound.

Computed Properties

Molecular Weight:214.56
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:213.9781343
Monoisotopic Mass:213.9781343
Topological Polar Surface Area:84.2
Heavy Atom Count:14
Complexity:279
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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