5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile
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5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile
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CAS No:
269726-49-0
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Formula:
C9H13N3
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Chemical Name:
5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile
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Synonyms:
5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile;1-tert-Butyl-5-aMino-1H-p...;2-Amino-1-(tert-butyl)-4-cyano-1H-pyrrole;1-tert-butyl-5-aMino-1H-pyrrole-3-carbonitrile
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CAS No:
5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile Basic Attributes
163.21962
163.110947
DTXSID00437973
2933990090
Safety Information
IRRITANT
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, 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:163.22
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:163.110947427
Monoisotopic Mass:163.110947427
Topological Polar Surface Area:54.7
Heavy Atom Count:12
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
5-Amino-1-(tert-butyl)-1H-pyrrole-3-carbonitrile
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