Isonitrosobenzoylacetone
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Isonitrosobenzoylacetone
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CAS No:
6797-44-0
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Formula:
C10H9NO3
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Chemical Name:
Isonitrosobenzoylacetone
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Synonyms:
1,2,3-Butanetrione,1-phenyl-,2-oxime;1-Phenylbutane-1,2,3-trione 2-oxime;Isonitrosobenzoylacetone;2-Hydroxyimino-1-phenyl-1,3-butanedione;1-Benzoyl-1-isonitrosoacetone;1-Isonitroso-1-benzoylacetone;2-(Hydroxyimino)-1-phenylbutan-1,3-dione;2-(N-Hydroxyimino)-1-phenylbutane-1,3-dione
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CAS No:
Safety Information
R36/37/38
S26-S36
|Danger|H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:191.18
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:191.058243149
Monoisotopic Mass:191.058243149
Topological Polar Surface Area:66.7
Heavy Atom Count:14
Complexity:265
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes