3-OCTANOL FORMATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H18O2
Molecular Weight	158.238
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-OCTANOL FORMATE

Structure Search

SMILES

CCCCCC(CC)OC=O

InChI

InChIKey=PPJCPDSDDKESKL-UHFFFAOYSA-N

InChI=1S/C9H18O2/c1-3-5-6-7-9(4-2)11-8-10/h8-9H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H18O2
Molecular Weight	158.238
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 21:31:09 UTC 2023` Edited by `admin` on `Fri Dec 15 21:31:09 UTC 2023`
Record UNII	2V9K8OE808
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-OCTANOL FORMATE

Systematic Name

English

3-OCTYL FORMATE

Systematic Name

English

3-OCTANOL, 3-FORMATE

Common Name

English

OCTAN-3-YL FORMATE, (±)-

Systematic Name

English

3-OCTANOL, FORMATE

Systematic Name

English

FEMA NO. 4009

Code

English

(±)-OCTAN-3-YL FORMATE [FHFI]

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

(+/-)-OCTAN-3-YL FORMATE

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

Code System Code Type Description

FDA UNII

2V9K8OE808

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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PUBCHEM

22757845

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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CAS

84434-65-1

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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JECFA MONOGRAPH

2046

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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EPA CompTox

DTXSID70868816

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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ECHA (EC/EINECS)

282-866-1

Created by admin on Fri Dec 15 21:31:09 UTC 2023 , Edited by admin on Fri Dec 15 21:31:09 UTC 2023

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