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4-Chloro-3-hydroxybutanenitrile

4-Chloro-3-hydroxybutanenitrile structure

4-Chloro-3-hydroxybutanenitrile 

structure
  • CAS No:

    105-33-9

  • Formula:

    C4H6ClNO

  • Chemical Name:

    4-Chloro-3-hydroxybutanenitrile

  • Synonyms:

    Butanenitrile,4-chloro-3-hydroxy-;Butyronitrile,4-chloro-3-hydroxy-;4-Chloro-3-hydroxybutanenitrile;4-Chloro-3-hydroxybutyronitrile;γ-Chloro-β-hydroxybutyronitrile;1-Chloro-3-cyano-2-propanol;637-75-2

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

4-Chloro-3-hydroxybutanenitrile Basic Attributes

119.549

119.55

203-287-2

2926909090

Characteristics

44.02000

-0.22

1.2515 g/cm3 @ Temp: 22 °C

138-141 °C @ Press: 18 Torr

126.9±21.8 °C

1.464

Safety Information

P260, P261, P264, P270, P271, P272, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P307+P311, P311, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P272, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P307+P311, P311, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 55 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Chloro-3-hydroxybutanenitrile Use and Manufacturing

Butanenitrile, 4-chloro-3-hydroxy-: INACTIVE

Computed Properties

Molecular Weight:119.55
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:119.0137915
Monoisotopic Mass:119.0137915
Topological Polar Surface Area:44
Heavy Atom Count:7
Complexity:84.9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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