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4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate structure

CAS No:
84078-44-4
Formula:
C27H42O2
Chemical Name:
4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate
Synonyms:
[1,1′-Bicyclohexyl]-4-carboxylic acid,4′-propyl-,4-pentylphenyl ester,(trans,trans)-;4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

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4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate Basic Attributes

Molecular Weight：

398.62100

Exact Mass：

398.62

EC Number：

617-528-8

Characteristics

PSA：

26.30000

XLogP3：

7.73760

Boiling Point：

529.55ºC

Flash Point：

249.222ºC

Safety Information

GHS Classification：

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:398.6
XLogP3:10
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:398.318480578
Monoisotopic Mass:398.318480578
Topological Polar Surface Area:26.3
Heavy Atom Count:29
Complexity:449
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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