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

Details

Stereochemistry	ACHIRAL
Molecular Formula	C39H60O8
Molecular Weight	656.8889
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=MFSAJLWSXLIOHZ-UHFFFAOYSA-N

InChI=1S/C39H60O8/c1-35(2,3)27-17-25(18-28(33(27)44)36(4,5)6)13-15-31(42)46-23-39(21-40,22-41)24-47-32(43)16-14-26-19-29(37(7,8)9)34(45)30(20-26)38(10,11)12/h17-20,40-41,44-45H,13-16,21-24H2,1-12H3

HIDE SMILES / InChI

Molecular Formula	C39H60O8
Molecular Weight	656.8889
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 `Sat Dec 16 10:39:53 GMT 2023` Edited by `admin` on `Sat Dec 16 10:39:53 GMT 2023`
Record UNII	2RS3YUM82C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

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

Systematic Name

English

NEOPENTYLGLYCOL BIS(3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONATE)

Common Name

English

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

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID101016685

Created by admin on Sat Dec 16 10:39:53 GMT 2023 , Edited by admin on Sat Dec 16 10:39:53 GMT 2023

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FDA UNII

2RS3YUM82C

Created by admin on Sat Dec 16 10:39:53 GMT 2023 , Edited by admin on Sat Dec 16 10:39:53 GMT 2023

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CAS

36913-60-7

Created by admin on Sat Dec 16 10:39:53 GMT 2023 , Edited by admin on Sat Dec 16 10:39:53 GMT 2023

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PUBCHEM

87747876

Created by admin on Sat Dec 16 10:39:53 GMT 2023 , Edited by admin on Sat Dec 16 10:39:53 GMT 2023

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