2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)sulfanyl]-4-methylphenol

2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)sulfanyl]-4-methylphenol

CAS: 90-66-4

Formula: C22H30O2S

SMILES: CC1=CC(SC2=CC(C)=CC(=C2O)C(C)(C)C)=C(O)C(=C1)C(C)(C)C

IUPAC: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)sulfanyl]-4-methylphenol

InChI: InChI=1S/C22H30O2S/c1-13-9-15(21(3,4)5)19(23)17(11-13)25-18-12-14(2)10-16(20(18)24)22(6,7)8/h9-12,23-24H,1-8H3

Composition: C (73.70%), H (8.43%), O (8.92%), S (8.94%)

Molar Mass: 358.54

Atom Count: 55

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	358.19665138
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	MQWCQFCZUNBTCM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	110.12
Topological Polar Surface Area	40.46
Polarizability	42.3
Ring Count	2
Rotatable Bond Count	4

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