PENTAERYTHRITOL TRIS(3,5-DI-TERT-BUTYL-4-HYDROXYHYDROCINNAMATE)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C56H84O10
Molecular Weight	917.2602
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAERYTHRITOL TRIS(3,5-DI-TERT-BUTYL-4-HYDROXYHYDROCINNAMATE)

Structure Search

SMILES

CC(C)(C)C1=CC(CCC(=O)OCC(CO)(COC(=O)CCC2=CC(=C(O)C(=C2)C(C)(C)C)C(C)(C)C)COC(=O)CCC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)=CC(=C1O)C(C)(C)C

InChI

InChIKey=PLTOWUBLEPQHQC-UHFFFAOYSA-N

InChI=1S/C56H84O10/c1-50(2,3)38-25-35(26-39(47(38)61)51(4,5)6)19-22-44(58)64-32-56(31-57,33-65-45(59)23-20-36-27-40(52(7,8)9)48(62)41(28-36)53(10,11)12)34-66-46(60)24-21-37-29-42(54(13,14)15)49(63)43(30-37)55(16,17)18/h25-30,57,61-63H,19-24,31-34H2,1-18H3

HIDE SMILES / InChI

Molecular Formula	C56H84O10
Molecular Weight	917.2602
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 16:51:26 GMT 2025` Edited by `admin` on `Tue Apr 01 16:51:26 GMT 2025`
Record UNII	2693091677
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAERYTHRITOL TRIS(3,5-DI-TERT-BUTYL-4-HYDROXYHYDROCINNAMATE)

Common Name

English

PENTAERYTHRITOL TRIS ESTER WITH 3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONIC ACID

Preferred Name

English

BENZENEPROPANOIC ACID, 3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-, 2-((3-(3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXYPHENYL)-1-OXOPROPOXY)METHYL)-2-(HYDROXYMETHYL)-1,3-PROPANEDIYL ESTER

Systematic Name

English

BENZENEPROPANOIC ACID, 3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-, 1,1'-(2-((3-(3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXYPHENYL)-1-OXOPROPOXY)METHYL)-2-(HYDROXYMETHYL)-1,3-PROPANEDIYL) ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

2693091677

Created by admin on Tue Apr 01 16:51:26 GMT 2025 , Edited by admin on Tue Apr 01 16:51:26 GMT 2025

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PUBCHEM

14401630

Created by admin on Tue Apr 01 16:51:26 GMT 2025 , Edited by admin on Tue Apr 01 16:51:26 GMT 2025

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CAS

84633-54-5

Created by admin on Tue Apr 01 16:51:26 GMT 2025 , Edited by admin on Tue Apr 01 16:51:26 GMT 2025

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EPA CompTox

DTXSID00904998

Created by admin on Tue Apr 01 16:51:26 GMT 2025 , Edited by admin on Tue Apr 01 16:51:26 GMT 2025

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