5-(chloromethyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
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5-(chloromethyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
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CAS No:
561009-04-9
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Formula:
C7H4ClF3N4O
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Chemical Name:
5-(chloromethyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
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Synonyms:
5-(CHLOROMETHYL)-2-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7(4H)-ONE;561009-04-9;5-(chloromethyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;5-(chloromethyl)-2-(trifluoromethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;SCHEMBL12325973;MFCD04610471;AKOS000122484;ZINC100004994;MCULE-4463658316;NE12871;AS-35886;SR-01000044908;SR-01000044908-1
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CAS No:
5-(chloromethyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Basic Attributes
252.58 g/mol
252.0025729 g/mol
Safety Information
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:252.58
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:252.0025729
Monoisotopic Mass:252.0025729
Topological Polar Surface Area:57.1
Heavy Atom Count:16
Complexity:439
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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