3,5-DI-TERT-BUTYL-4-HYDROXYBENZYLTHIOGLYCOLLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H26O3S
Molecular Weight	310.452
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-DI-TERT-BUTYL-4-HYDROXYBENZYLTHIOGLYCOLLATE

Structure Search

SMILES

CC(C)(C)C1=CC(COC(=O)CS)=CC(=C1O)C(C)(C)C

InChI

InChIKey=XNAQFHAPGGRYKF-UHFFFAOYSA-N

InChI=1S/C17H26O3S/c1-16(2,3)12-7-11(9-20-14(18)10-21)8-13(15(12)19)17(4,5)6/h7-8,19,21H,9-10H2,1-6H3

HIDE SMILES / InChI

Molecular Formula	C17H26O3S
Molecular Weight	310.452
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:05:19 GMT 2025` Edited by `admin` on `Mon Mar 31 23:05:19 GMT 2025`
Record UNII	89556DSU2Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DBHBT

Preferred Name

English

3,5-DI-TERT-BUTYL-4-HYDROXYBENZYLTHIOGLYCOLLATE

Common Name

English

2-MERCAPTOACETIC ACID (3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXYPHENYL)METHYL ESTER

Systematic Name

English

DBHBT [MI]

Common Name

English

ACETIC ACID, 2-MERCAPTO-, (3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXYPHENYL)METHYL ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

89556DSU2Y

Created by admin on Mon Mar 31 23:05:19 GMT 2025 , Edited by admin on Mon Mar 31 23:05:19 GMT 2025

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CAS

63147-28-4

Created by admin on Mon Mar 31 23:05:19 GMT 2025 , Edited by admin on Mon Mar 31 23:05:19 GMT 2025

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MERCK INDEX

m4109

Created by admin on Mon Mar 31 23:05:19 GMT 2025 , Edited by admin on Mon Mar 31 23:05:19 GMT 2025

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Merck Index

PUBCHEM

9944538

Created by admin on Mon Mar 31 23:05:19 GMT 2025 , Edited by admin on Mon Mar 31 23:05:19 GMT 2025

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