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2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol

2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol structure

CAS No:
130116-03-9
Formula:
C16H22N2OS2
Chemical Name:
2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol
Synonyms:
2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol;CHEMBL16659;2,6-di-tert-butyl-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)phenol;CHEMBL122193;Ethanaminium,2-hydroxy-N,N,N-trimethyl-,salt with 5-[3,5-bis(1,1-dimethylethyl)-4- hydroxyphenyl]-1,3,4-thiadiazole-2(3H)-thione (1:1);ACMC-20mti9;SCHEMBL2694570;CTK4B6530;KS-00001XSV;ZINC6262659

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2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol Basic Attributes

Molecular Weight：

322.49

Exact Mass：

322.117

Characteristics

PSA：

98.5

XLogP3：

5.1

Melting Point：

242 - 243 °C (toluene)

Computed Properties

Molecular Weight:322.5
XLogP3:5.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:322.11735568
Monoisotopic Mass:322.11735568
Topological Polar Surface Area:102
Heavy Atom Count:21
Complexity:424
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

148773-27-7

130116-03-9

130116-79-9

130116-03-9

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Guide of 2,6-di(tert-butyl)-4-(5-sulfanyl-1,3,4-thiadiazol-2-yl)benzenol

Basic Attributes
Characteristics
Computed Properties
Synthesis Route

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