1,4,7-Octanetriol

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NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C8H18O3
Molecular Weight	162.2267
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,4,7-Octanetriol

Structure Search

SMILES

CC(O)CCC(O)CCCO

InChI

InChIKey=VPJIDASIZYCWGX-UHFFFAOYSA-N

InChI=1S/C8H18O3/c1-7(10)4-5-8(11)3-2-6-9/h7-11H,2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C8H18O3
Molecular Weight	162.2267
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 `Wed Apr 02 12:05:01 GMT 2025` Edited by `admin` on `Wed Apr 02 12:05:01 GMT 2025`
Record UNII	62YMR4JQ95
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-18520

Preferred Name

English

1,4,7-Octanetriol

Systematic Name

English

Octane-1,4,7-triol

Systematic Name

English

Code System Code Type Description

PUBCHEM

227182

Created by admin on Wed Apr 02 12:05:01 GMT 2025 , Edited by admin on Wed Apr 02 12:05:01 GMT 2025

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CAS

5432-79-1

Created by admin on Wed Apr 02 12:05:01 GMT 2025 , Edited by admin on Wed Apr 02 12:05:01 GMT 2025

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NSC

18520

Created by admin on Wed Apr 02 12:05:01 GMT 2025 , Edited by admin on Wed Apr 02 12:05:01 GMT 2025

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EPA CompTox

DTXSID90280753

Created by admin on Wed Apr 02 12:05:01 GMT 2025 , Edited by admin on Wed Apr 02 12:05:01 GMT 2025

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FDA UNII

62YMR4JQ95

Created by admin on Wed Apr 02 12:05:01 GMT 2025 , Edited by admin on Wed Apr 02 12:05:01 GMT 2025

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