[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate
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![[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/69e2b597e6d14c6d9ab9d2a93eb0119a.png "[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate")
[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate
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CAS No:
112087-08-8
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Formula:
C26H31NO3S
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Chemical Name:
[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate
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Synonyms:
CHEMBL4546406;ZINC3012622;Toluene-4-sulfonic acid 2,6-diisopropyl-4-p-tolylamino-phenyl ester;AKOS001044619;MCULE-4770740466;Z56871736;4-[(4-methylphenyl)amino]-2,6-bis(propan-2-yl)phenyl 4-methylbenzene-1-sulfonate;112087-08-8
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CAS No:
[4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Basic Attributes
437.6 g/mol
437.20246502 g/mol
Computed Properties
Molecular Weight:437.6
XLogP3:7.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:437.20246502
Monoisotopic Mass:437.20246502
Topological Polar Surface Area:63.8
Heavy Atom Count:31
Complexity:622
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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