N-(1,1-Dimethylethyl)thiourea
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N-(1,1-Dimethylethyl)thiourea
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CAS No:
7204-48-0
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Formula:
C5H12N2S
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Chemical Name:
N-(1,1-Dimethylethyl)thiourea
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Synonyms:
Thiourea,N-(1,1-dimethylethyl)-;Urea,1-tert-butyl-2-thio-;Thiourea,(1,1-dimethylethyl)-;N-(1,1-Dimethylethyl)thiourea;1-tert-Butylthiourea;1-tert-Butyl-2-thiourea;N-tert-Butylthiourea;tert-Butylthiourea
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CAS No:
Characteristics
70.1
1.70930
1.028g/cm3
171-172 °C (decomp) @ Solvent: Water
187.2±23.0℃ (760 Torr)
67.0±22.6℃
1.527
Safety Information
III
IRRITANT
22
22-36/37
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (85.71%): 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, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:132.23
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:132.07211956
Monoisotopic Mass:132.07211956
Topological Polar Surface Area:70.1
Heavy Atom Count:8
Complexity:93.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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