4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate
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4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate
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CAS No:
84236-44-2
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Formula:
C26H36O3
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Chemical Name:
4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate
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Synonyms:
4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate;4-(2-Methylbutyl)phenyl (1)-4-octyloxybenzoate;Benzoic acid, 4-(octyloxy)-, 4-(2-methylbutyl)phenyl ester;Einecs 282-476-1
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CAS No:
4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate Basic Attributes
396.56
396.56
282-476-1
TSCA listed
DTXSID90276116
4-(2-methylbutyl)phenyl (±)-4-octyloxybenzoate Use and Manufacturing
Benzoic acid, 4-(octyloxy)-, 4-(2-methylbutyl)phenyl ester: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:396.6
XLogP3:8.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:14
Exact Mass:396.26644501
Monoisotopic Mass:396.26644501
Topological Polar Surface Area:35.5
Heavy Atom Count:29
Complexity:420
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-(2-Methylbutyl)phenyl 4′-octyl[1,1′-biphenyl]-4-carboxylate Formula
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4-(2-Methylbutyl)phenyl 4-propylbenzoate Formula
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4-(2-Methylbutyl)phenyl 4-(dodecyloxy)benzoate Formula
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4-(2-Methylbutyl)phenyl 4-pentylbenzoate Structure
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4-(2-Methylbutyl)phenyl 4′-pentyl[1,1′-biphenyl]-4-carboxylate Structure
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