HEXANAL OCTANE-1,3-DIOL ACETAL

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NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C14H28O2
Molecular Weight	228.3709
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXANAL OCTANE-1,3-DIOL ACETAL

Structure Search

SMILES

CCCCCC1CCOC(CCCCC)O1

InChI

InChIKey=JTGGXBHDIVDFHP-UHFFFAOYSA-N

InChI=1S/C14H28O2/c1-3-5-7-9-13-11-12-15-14(16-13)10-8-6-4-2/h13-14H,3-12H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C14H28O2
Molecular Weight	228.3709
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:29:43 UTC 2023` Edited by `admin` on `Fri Dec 15 19:29:43 UTC 2023`
Record UNII	8K24ODV341
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HEXANAL OCTANE-1,3-DIOL ACETAL

Common Name

English

(±)-HEXANAL OCTANE-1,3-DIOL ACETAL

Common Name

English

HEXANAL OCTANE-1,3-DIOL ACETAL, (±)-

Common Name

English

ALDEHYDE C-6 OCTANE-1,3-DIOL ACETAL

Common Name

English

2,4-DIPENTYL-1,3-DIOXANE

Systematic Name

English

FEMA NO. 4377

Code

English

HEXANAL OCTANE-1,3-DIOL ACETAL [FHFI]

Common Name

English

HEXANAL 1,3-OCTANEDIOL ACETAL

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

HEXANAL OCTANE-1,3-DIOL ACETAL

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID10942301

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

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PUBCHEM

526993

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

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CAS

202188-46-3

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

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JECFA MONOGRAPH

1714

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

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FDA UNII

8K24ODV341

Created by admin on Fri Dec 15 19:29:43 UTC 2023 , Edited by admin on Fri Dec 15 19:29:43 UTC 2023

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