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3-isocyanatopyridine

3-isocyanatopyridine structure

3-isocyanatopyridine 

structure
  • CAS No:

    15268-31-2

  • Formula:

    C6H4N2O

  • Chemical Name:

    3-isocyanatopyridine

  • Synonyms:

    3-pyridinyl isocyanate; Pyridine-3-isocyanate; pyridin-3-isocyanate; 3-Pyridyl isocyanate; pyridin-3-yl isocyanate; 3-isocyanato-pyridine;Expand

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

3-isocyanatopyridine Basic Attributes

120.10900

120.032362755

DTXSID00375184

2933399090

Characteristics

42.32000

1.04890

1.12 g/cm3

181.9ºC at 760 mmHg

63.8ºC

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:120.11
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:120.032362755
Monoisotopic Mass:120.032362755
Topological Polar Surface Area:42.3
Heavy Atom Count:9
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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