DIPENTAERYTHRITYL HEXAETHYLHEXANOATE

Details

Stereochemistry	MIXED
Molecular Formula	C58H106O13
Molecular Weight	1011.4544
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIPENTAERYTHRITYL HEXAETHYLHEXANOATE

Structure Search

SMILES

CCCCC(CC)C(=O)OCC(COCC(COC(=O)C(CC)CCCC)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC

InChI

InChIKey=IPPHBUQCGBKELK-UHFFFAOYSA-N

InChI=1S/C58H106O13/c1-13-25-31-45(19-7)51(59)66-39-57(40-67-52(60)46(20-8)32-26-14-2,41-68-53(61)47(21-9)33-27-15-3)37-65-38-58(42-69-54(62)48(22-10)34-28-16-4,43-70-55(63)49(23-11)35-29-17-5)44-71-56(64)50(24-12)36-30-18-6/h45-50H,13-44H2,1-12H3

HIDE SMILES / InChI

Molecular Formula	C58H106O13
Molecular Weight	1011.4544
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:49:23 GMT 2023` Edited by `admin` on `Sat Dec 16 01:49:23 GMT 2023`
Record UNII	E56131A16B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIPENTAERYTHRITYL HEXAETHYLHEXANOATE

Common Name

English

HEXANOIC ACID, 2-ETHYL-, 2-((3-((2-ETHYL-1-OXOHEXYL)OXY)-2,2-BIS(((2-ETHYL-1-OXOHEXYL)OXY)METHYL)PROPOXY)METHYL)-2-(((2-ETHYL-1-OXOHEXYL)OXY)METHYL)-1,3-PROPANEDIYL ESTER

Common Name

English

Code System Code Type Description

CAS

102189-97-9

Created by admin on Sat Dec 16 01:49:23 GMT 2023 , Edited by admin on Sat Dec 16 01:49:23 GMT 2023

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EPA CompTox

DTXSID40109913

Created by admin on Sat Dec 16 01:49:23 GMT 2023 , Edited by admin on Sat Dec 16 01:49:23 GMT 2023

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PUBCHEM

71587388

Created by admin on Sat Dec 16 01:49:23 GMT 2023 , Edited by admin on Sat Dec 16 01:49:23 GMT 2023

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FDA UNII

E56131A16B

Created by admin on Sat Dec 16 01:49:23 GMT 2023 , Edited by admin on Sat Dec 16 01:49:23 GMT 2023

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