4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate
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![4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/af32244a3a4d4652895de4db23b68d15.png "4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate")
4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate
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CAS No:
94442-17-8
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Formula:
C21H26O2
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Chemical Name:
4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate
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Synonyms:
Benzoic acid,4-propyl-,4-[(2S)-2-methylbutyl]phenyl ester;Benzoic acid,4-propyl-,4-(2-methylbutyl)phenyl ester,(S)-;4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate
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CAS No:
4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate Basic Attributes
310.4 g/mol
310.43
305-343-2
VJX826QN15
4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate Use and Manufacturing
Benzoic acid, 4-propyl-, 4-[(2S)-2-methylbutyl]phenyl ester: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:310.4
XLogP3:6.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:310.193280068
Monoisotopic Mass:310.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:23
Complexity:336
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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ethyl 4-propylbenzoate Formula
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