Parabanic acid
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Parabanic acid
structure -
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CAS No:
120-89-8
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Formula:
C3H2N2O3
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Chemical Name:
Parabanic acid
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Synonyms:
2,4,5-Imidazolidinetrione;Parabanic acid;Imidazolidinetrione;Oxalylurea;Trioxoimidazolidine;NSC 9789;Parabenic acid
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CAS No:
Description
Parabanic acid is an imidazolidinone that is imidazolidine which is substituted by oxo groups at positions 2, 4 and 5. It has a role as a human metabolite. It is an imidazolidinone and a hydracid. It derives from a hydride of an imidazolidine.
Safety Information
3
36/37/38
26-36
Xi
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Parabanic acid Use and Manufacturing
A useful synthetic intermediate
2,4,5-Imidazolidinetrione: ACTIVE
Computed Properties
Molecular Weight:114.06
XLogP3:-0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:114.00654193
Monoisotopic Mass:114.00654193
Topological Polar Surface Area:75.3
Heavy Atom Count:8
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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