(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate
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![(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220805/23b6fd7ee9274b39abd5ebdd2f9f1a4f.png "(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate")
(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate
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CAS No:
729564-13-0
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Formula:
C23H21ClO2S
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Chemical Name:
(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate
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Synonyms:
ZINC3281522;AKOS033974827;MCULE-8807381742;NCGC00336298-01;AB01330107-02;Z26775717;2,3,6-trimethylphenyl 4-{[(4-chlorophenyl)sulfanyl]methyl}benzoate;729564-13-0
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CAS No:
(2,3,6-trimethylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Basic Attributes
396.9 g/mol
396.0950788 g/mol
Computed Properties
Molecular Weight:396.9
XLogP3:7.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:396.0950788
Monoisotopic Mass:396.0950788
Topological Polar Surface Area:51.6
Heavy Atom Count:27
Complexity:469
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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