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Home > Encyclopedia > 4-BENZYLOXYBENZONITRILE

4-BENZYLOXYBENZONITRILE

4-BENZYLOXYBENZONITRILE structure

4-BENZYLOXYBENZONITRILE 

structure
  • CAS No:

    52805-36-4

  • Formula:

    C14H11NO

  • Chemical Name:

    4-BENZYLOXYBENZONITRILE

  • Synonyms:

    4-Benzyloxybenzonitrile;52805-36-4;4-(benzyloxy)benzonitrile;4-phenylmethoxybenzonitrile;4-Benzyloxy-benzonitrile;Benzonitrile, 4-(phenylmethoxy)-;4-(phenylmethoxy)benzenecarbonitrile;431946-37-1;4-benzyloxy benzonitrile;Maybridge1_005982

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

4-BENZYLOXYBENZONITRILE Basic Attributes

209.24

209.084061

2372698

-0

2926909090

Characteristics

33

3.53

1.1±0.1 g/cm3

94 °C

173-175°C0,1mm

173-175°C/0.1mm

1.598

Safety Information

III

6.1

3276

20/21/22-36/37/38-22

26-36/37/39-36

Xi

P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301

|Danger|H301 (16.67%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:209.24
XLogP3:3.5
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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