3,5-DI-TERT-BUTYL-4-HYDROXYBENZYL ACETATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H26O3
Molecular Weight	278.3865
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-DI-TERT-BUTYL-4-HYDROXYBENZYL ACETATE

Structure Search

SMILES

CC(=O)OCC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C

InChI

InChIKey=UJQUIYGYEMWYBS-UHFFFAOYSA-N

InChI=1S/C17H26O3/c1-11(18)20-10-12-8-13(16(2,3)4)15(19)14(9-12)17(5,6)7/h8-9,19H,10H2,1-7H3

HIDE SMILES / InChI

Molecular Formula	C17H26O3
Molecular Weight	278.3865
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:05:19 GMT 2025` Edited by `admin` on `Tue Apr 01 19:05:19 GMT 2025`
Record UNII	PDY4WFX2LZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-35974

Preferred Name

English

3,5-DI-TERT-BUTYL-4-HYDROXYBENZYL ACETATE

Systematic Name

English

(3,5-DITERT-BUTYL-4-HYDROXYPHENYL)METHYL ACETATE

Systematic Name

English

ACETIC ACID 3,5-DI-TERT-BUTYL-4-HYDROXY-BENZYL ESTER

Common Name

English

BENZENEMETHANOL, 3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-, ACETATE

Systematic Name

English

Code System Code Type Description

FDA UNII

PDY4WFX2LZ

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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NSC

35974

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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PUBCHEM

84404

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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CAS

14387-17-8

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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EPA CompTox

DTXSID90162565

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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ECHA (EC/EINECS)

238-357-1

Created by admin on Tue Apr 01 19:05:19 GMT 2025 , Edited by admin on Tue Apr 01 19:05:19 GMT 2025

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