OCTYL ADIPATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H26O4
Molecular Weight	258.3538
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OCTYL ADIPATE

Structure Search

SMILES

CCCCCCCCOC(=O)CCCCC(O)=O

InChI

InChIKey=IHLDEDLAZNFOJB-UHFFFAOYSA-N

InChI=1S/C14H26O4/c1-2-3-4-5-6-9-12-18-14(17)11-8-7-10-13(15)16/h2-12H2,1H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula	C14H26O4
Molecular Weight	258.3538
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 `Fri Dec 15 17:50:14 GMT 2023` Edited by `admin` on `Fri Dec 15 17:50:14 GMT 2023`
Record UNII	2ZZD3RV7T2
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

OCTYL ADIPATE

Systematic Name

English

HEXANEDIOIC ACID, 1-OCTYL ESTER

Systematic Name

English

MONOOCTYL ADIPATE

Systematic Name

English

ADIPIC ACID, OCTYL ESTER

Systematic Name

English

ADIPIC ACID, MONOOCTYL ESTER

Systematic Name

English

OCTYL ALCOHOL, ADIPATE

Systematic Name

English

HEXANEDIOIC ACID, MONOOCTYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

17961-12-5

Created by admin on Fri Dec 15 17:50:14 GMT 2023 , Edited by admin on Fri Dec 15 17:50:14 GMT 2023

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ECHA (EC/EINECS)

241-885-5

Created by admin on Fri Dec 15 17:50:14 GMT 2023 , Edited by admin on Fri Dec 15 17:50:14 GMT 2023

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EPA CompTox

DTXSID30170846

Created by admin on Fri Dec 15 17:50:14 GMT 2023 , Edited by admin on Fri Dec 15 17:50:14 GMT 2023

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PUBCHEM

87374

Created by admin on Fri Dec 15 17:50:14 GMT 2023 , Edited by admin on Fri Dec 15 17:50:14 GMT 2023

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FDA UNII

2ZZD3RV7T2

Created by admin on Fri Dec 15 17:50:14 GMT 2023 , Edited by admin on Fri Dec 15 17:50:14 GMT 2023

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