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1,3-ditert-butyl-2H-imidazol-1-ium-2-ide

1,3-ditert-butyl-2H-imidazol-1-ium-2-ide structure

CAS No:
157197-53-0
Formula:
C11H20N2
Chemical Name:
1,3-ditert-butyl-2H-imidazol-1-ium-2-ide
Synonyms:
1,3-Di-tert-butyliMidazol-2-ylidene; 1,3-Di-tert-butyl-1H-imidazol-3-ium-2-ide; 1,3-DI-T-BUTYLIMIDAZOL-2-YLIDENE; 1,3-di-tert-butyl-1,3-imidazol-2-ylidene; 1.3-di-tetrt-butyl-1,3-imidazol-2-ylidene; ItBu; N,N'-di-tert-butylimidazolin-2-ylidene;Expand

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1,3-ditert-butyl-2H-imidazol-1-ium-2-ide Basic Attributes

Molecular Weight：

180.29000

Exact Mass：

180.162648646

DSSTox ID：

DTXSID20449891

HScode：

2933290090

Characteristics

PSA：

6.48000

XLogP3：

2.25790

Melting Point：

71-72ºC

Boiling Point：

233.32ºC

Flash Point：

86.27ºC

Storage Conditions：

Refrigerator

Vapor Pressure：

0.056mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

GHS Classification：

|Warning|H228 (50%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:180.29
XLogP3:1.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:180.162648646
Monoisotopic Mass:180.162648646
Topological Polar Surface Area:6.2
Heavy Atom Count:13
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: lithium carbonate formula; calcium carbonate compound formula; disodium pyrophosphate; benzyl benzoate; potassium sulfide formula; sodium acetate chemical formula

Guide of 1,3-ditert-butyl-2H-imidazol-1-ium-2-ide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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