2,4,5-Tri-tert-butylphenol

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H30O
Molecular Weight	262.4302
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4,5-Tri-tert-butylphenol

Structure Search

SMILES

CC(C)(C)C1=CC(=C(C=C1O)C(C)(C)C)C(C)(C)C

InChI

InChIKey=XRXSBCHCLGSTHW-UHFFFAOYSA-N

InChI=1S/C18H30O/c1-16(2,3)12-10-14(18(7,8)9)15(19)11-13(12)17(4,5)6/h10-11,19H,1-9H3

HIDE SMILES / InChI

Molecular Formula	C18H30O
Molecular Weight	262.4302
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 19:20:23 GMT 2025` Edited by `admin` on `Tue Apr 01 19:20:23 GMT 2025`
Record UNII	SF5M7L4V2R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4,5-Tris(1,1-dimethylethyl)phenol

Preferred Name

English

2,4,5-Tri-tert-butylphenol

Systematic Name

English

Phenol, 2,4,5-tris(1,1-dimethylethyl)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80232766

Created by admin on Tue Apr 01 19:20:23 GMT 2025 , Edited by admin on Tue Apr 01 19:20:23 GMT 2025

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CAS

83875-92-7

Created by admin on Tue Apr 01 19:20:23 GMT 2025 , Edited by admin on Tue Apr 01 19:20:23 GMT 2025

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ECHA (EC/EINECS)

281-151-1

Created by admin on Tue Apr 01 19:20:23 GMT 2025 , Edited by admin on Tue Apr 01 19:20:23 GMT 2025

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PUBCHEM

3019433

Created by admin on Tue Apr 01 19:20:23 GMT 2025 , Edited by admin on Tue Apr 01 19:20:23 GMT 2025

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FDA UNII

SF5M7L4V2R

Created by admin on Tue Apr 01 19:20:23 GMT 2025 , Edited by admin on Tue Apr 01 19:20:23 GMT 2025

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