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Home > Encyclopedia > 5-CHLORO-2-HYDROXYBENZONITRILE

5-CHLORO-2-HYDROXYBENZONITRILE

5-CHLORO-2-HYDROXYBENZONITRILE structure

5-CHLORO-2-HYDROXYBENZONITRILE 

structure
  • CAS No:

    13589-72-5

  • Formula:

    C7H4ClNO

  • Chemical Name:

    5-CHLORO-2-HYDROXYBENZONITRILE

  • Synonyms:

    5-CHLORO-2-HYDROXYBENZONITRILE;AKOS B029245;5-Chloro-2-hydroxybenzonitrile, tech;4-Chloro-2-cyanophenol;4-Chloro-2-cyanophenol, 5-Chlorosalicylonitrile;Benzonitrile, 5-chloro-2-hydroxy-;2-Hydroxy-5-chlorobenzonitrile;5-Chlorosalicylonitrile

  • Categories:

    Organic Chemistry  >  Coordination Complexes

5-CHLORO-2-HYDROXYBENZONITRILE Basic Attributes

153.57

152.998138

DTXSID00380516

2926909090

Characteristics

44

2.7

1.41±0.1 g/cm3(Predicted)

152-154°C

269.4±25.0 °C(Predicted)

116.7±23.2 °C

1.611

0.00438mmHg at 25°C

Safety Information

3276

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

26-36/37/39

Xi

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

H302+H312

5-CHLORO-2-HYDROXYBENZONITRILE Use and Manufacturing

Reference Step SStep S23 g of 5-chloro-2-hydroxybenzaldehyde oxime was added to 190 mlAcetic anhydride, heated to reflux for 2 hours, concentrated, the residue was poured into ice water, ethyl acetate extraction and liquid separation, the organic phase was collected, dried, concentrated, and the column was separated to give 16g5-chloro-2-hydroxybenzonitrile.

Computed Properties

Molecular Weight:153.56
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:152.9981414
Monoisotopic Mass:152.9981414
Topological Polar Surface Area:44
Heavy Atom Count:10
Complexity:162
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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