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trans-4-(4-Propylcyclohexyl)benzonitrile

trans-4-(4-Propylcyclohexyl)benzonitrile structure

trans-4-(4-Propylcyclohexyl)benzonitrile 

structure
  • CAS No:

    61203-99-4

  • Formula:

    C16H21N

  • Chemical Name:

    trans-4-(4-Propylcyclohexyl)benzonitrile

  • Synonyms:

    4-(TRANS-4'-N-PROPYLCYCLOHEXYL)BENZONITRILE;4-Trans-Propylcyclohexylcyanobenzene;4-Trans-PropylcyclohexylBenzonitrile;1-cyano-4-(trans-4-propylcyclohexyl)benzene;4-(trans-4-propylcyclohexyl)benzonitrile;4-(4-propylcyclohexyl)-,trans-Benzonitrile;PCH3;trans-4-(4-Propylcyclohexyl)benzonitrile

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

White crystalline

trans-4-(4-Propylcyclohexyl)benzonitrile Basic Attributes

227.35

227.34

262-654-5

TSCA listed

White to Almost white

2926.90.4801

Characteristics

23.8

5.5

0.98±0.1 g/cm3(Predicted)

45 °C

351.8±21.0 °C(Predicted)

167.4±14.6 °C

1.529

Sealed in dry,Room Temperature

Safety Information

III

6.1

UN 3439 6.1/PG III

P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301

UN 3439 6.1/PG III

|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, 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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

trans-4-(4-Propylcyclohexyl)benzonitrile Use and Manufacturing

Uses

Intermediates of Liquid Crystals

Benzonitrile, 4-(trans-4-propylcyclohexyl)-: ACTIVE

Computed Properties

Molecular Weight:227.34
XLogP3:5.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:227.167399674
Monoisotopic Mass:227.167399674
Topological Polar Surface Area:23.8
Heavy Atom Count:17
Complexity:259
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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