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Home > Encyclopedia > 4-Cyanoindole

4-Cyanoindole

4-Cyanoindole structure

4-Cyanoindole 

structure
  • CAS No:

    16136-52-0

  • Formula:

    C9H6N2

  • Chemical Name:

    4-Cyanoindole

  • Synonyms:

    1H-INDOL-4-AMINE;1H-INDOL-4-YLAMINE;4-CYANOINDOLE;4-AMINO-1H-INDOLE;INDOLE-4-AMINE;INDOLE-4-CARBONITRILE;4-Cyanoindoline;4-Cyanoindole, 97+%

4-Cyanoindole Basic Attributes

142.16

142.053101

1308068-626-2

DTXSID80396837

29339900

Characteristics

39.6

2.5

Off-white to pale brown Solid

1.24±0.1 g/cm3(Predicted)

117-121 °C(lit.)

350.0±15.0 °C(Predicted)

121.9±5.6 °C

1.675

Soluble in water.

−20°C

4.51E-05mmHg at 25°C

Safety Information

III

6.1

3439

3

36/37/38-43-41-37/38-22

26-36/37/39

Xn,Xi

P261-P280-P305 + P351 + P338

H302-H315-H317-H318-H335

|Danger|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P333+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:142.16
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:142.053098200
Monoisotopic Mass:142.053098200
Topological Polar Surface Area:39.6
Heavy Atom Count:11
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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