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4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile

4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile structure

CAS No:
68065-81-6
Formula:
C24H29N
Chemical Name:
4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile
Synonyms:
[1,1′-Biphenyl]-4-carbonitrile,4′-(trans-4-pentylcyclohexyl)-;[1,1′-Biphenyl]-4-carbonitrile,4′-(4-pentylcyclohexyl)-,trans-;4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile;Licristal S 1131;S 1131;4-Cyano-4′-(trans-4-pentylcyclohexyl)biphenyl;4-(trans-4-Pentylcyclohexyl)-4′-cyanobiphenyl;BCH 5;ZLI 1131;5-HBB-C;5CCB
Categories:
Pharmaceutical Intermediates > Oled Material Intermediate

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4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile Basic Attributes

Molecular Weight：

331.49

Exact Mass：

331.49

EC Number：

268-333-6

Characteristics

PSA：

23.8 Å²

Density：

1.03±0.1 g/cm3

Melting Point：

95-97°C

Boiling Point：

211°C(lit.)

Water Solubility：

Slightly soluble in water.

Safety Information

safety instructions：

22-24/25

GHS Classification：

|Warning|H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, 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.

4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile Use and Manufacturing

Uses

Intermediates of Liquid Crystals

Manufacturing Info：

[1,1'-Biphenyl]-4-carbonitrile, 4'-(trans-4-pentylcyclohexyl)-: ACTIVE

Computed Properties

Molecular Weight:331.5
XLogP3:8.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:6
Exact Mass:331.229999929
Monoisotopic Mass:331.229999929
Topological Polar Surface Area:23.8
Heavy Atom Count:25
Complexity:409
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 68065-81-6

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Latest News on 4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile

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Guide of 4′-(trans-4-Pentylcyclohexyl)[1,1′-biphenyl]-4-carbonitrile

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
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