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4-Phenoxyphenylacetonitrile

4-Phenoxyphenylacetonitrile structure

4-Phenoxyphenylacetonitrile 

structure
  • CAS No:

    92163-15-0

  • Formula:

    C14H11NO

  • Chemical Name:

    4-Phenoxyphenylacetonitrile

  • Synonyms:

    TIMTEC-BB SBB005900;4-Phenoxybenzyl cyanide;4-PHENOXYPHENYLACETONITRILE;2-(4-PHENOXYPHENYL)ACETONITRILE

4-Phenoxyphenylacetonitrile Basic Attributes

209.248

209.084061

DTXSID30380726

2926909090

Characteristics

33

3.44

1.1±0.1 g/cm3

349.8±25.0 °C at 760 mmHg

147.6±17.0 °C

1.582

Safety Information

III

6.1

3276

3

R20/21/22;R36/37/38

S23-S26-S36

Xn:Harmful;

P261-P280-P305 + P351 + P338

H302-H312-H315-H319-H332-H335

|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|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:209.24
XLogP3:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:209.084063974
Monoisotopic Mass:209.084063974
Topological Polar Surface Area:33
Heavy Atom Count:16
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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