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N-(1,1-Dimethylethyl)thiourea

N-(1,1-Dimethylethyl)thiourea structure

CAS No:
7204-48-0
Formula:
C5H12N2S
Chemical Name:
N-(1,1-Dimethylethyl)thiourea
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
Categories:
Chemical Reagents > Organic Reagents

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N-(1,1-Dimethylethyl)thiourea Basic Attributes

Molecular Weight：

132.23

Exact Mass：

132.23

BRN：

1744506

DSSTox ID：

DTXSID90353234

Characteristics

PSA：

70.1

XLogP3：

1.70930

Density：

1.028g/cm3

Melting Point：

171-172 °C (decomp) @ Solvent: Water

Boiling Point：

187.2±23.0℃ (760 Torr)

Flash Point：

67.0±22.6℃

Refractive Index：

1.527

Safety Information

Packing level：

III

Hazard category：

IRRITANT

hazard class code：

safety instructions：

22-36/37

Precautionary statement(s)：

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

Hazard Statements：

H302

GHS Classification：

|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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Guide of N-(1,1-Dimethylethyl)thiourea

Basic Attributes
Characteristics
Safety Information
Computed Properties
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N-(1,1-Dimethylethyl)thiourea

SDS

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