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3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE

3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE structure

CAS No:
1611-07-0
Formula:
C16H23NO
Chemical Name:
3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE
Synonyms:
2-[3,5-DI(TERT-BUTYL)-4-HYDROXYPHENYL]ACETONITRILE;(3,5-DI-T-BUTYL-4-HYDROXYPHENYL)ACETONITRILE;3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE;3,5-Di-tert-butyl-4-hydroxyphenylacetonitrile, 98;3,5-di-tert-butyl-4-hydroxybenzyl cyanide;3,5-Bis(tert-butyl)-4-hydroxyphenylacetonitrile

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3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE Basic Attributes

Molecular Weight：

245.36

Exact Mass：

245.177963

DSSTox ID：

DTXSID70346841

HScode：

2926909090

Characteristics

PSA：

XLogP3：

4.09

Appearance：

Colourless to light yellow crystalline solid

Density：

0.991±0.06 g/cm3(Predicted)

Melting Point：

104 °C

Boiling Point：

323.0±37.0 °C(Predicted)

Flash Point：

149.2±26.5 °C

Refractive Index：

1.513

Vapor Pressure：

0.000143mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

hazard class code：

20/21/22

safety instructions：

22-36/37/39-45

Marks：

Hazard note：

Irritant

Computed Properties

Molecular Weight:245.36
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:245.177964357
Monoisotopic Mass:245.177964357
Topological Polar Surface Area:44
Heavy Atom Count:18
Complexity:301
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ammonium sulfate formula; ammonium carbonate; etoricoxib drug; formula of potassium sulphate; calcium ammonium nitrate; cl2o7

Guide of 3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3,5-DI-TERT-BUTYL-4-HYDROXYPHENYLACETONITRILE

SDS

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