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Home > Encyclopedia > 6-Acetyl-2(3H)-benzoxazolone

6-Acetyl-2(3H)-benzoxazolone

6-Acetyl-2(3H)-benzoxazolone structure

6-Acetyl-2(3H)-benzoxazolone 

structure
  • CAS No:

    54903-09-2

  • Formula:

    C9H7NO3

  • Chemical Name:

    6-Acetyl-2(3H)-benzoxazolone

  • Synonyms:

    2(3H)-Benzoxazolone,6-acetyl-;6-Acetyl-2(3H)-benzoxazolone;6-Acetyl-2-benzoxazolinone;6-Acetyl-3H-benzoxazol-2-one;6-Acetylbenzo[d]oxazol-2(3H)-one;1-(2-Hydroxy-1,3-benzoxazol-6-yl)ethan-1-one

6-Acetyl-2(3H)-benzoxazolone Basic Attributes

177.159

177.16

DTXSID20203399

2934999090

Characteristics

63.07000

1.32370

1.325g/cm3

227-228 °C @ Solvent: Ethanol

1.577

Safety Information

DM5285500

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

|Warning|H302 (16.67%): 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 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:177.16
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:177.042593085
Monoisotopic Mass:177.042593085
Topological Polar Surface Area:55.4
Heavy Atom Count:13
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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