ETHYL (E)-2-HEPTENOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H16O2
Molecular Weight	156.2221
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ETHYL (E)-2-HEPTENOATE

Structure Search

SMILES

CCCC\C=C\C(=O)OCC

InChI

InChIKey=CYLQPOIZDBIXFP-BQYQJAHWSA-N

InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3/b8-7+

HIDE SMILES / InChI

Molecular Formula	C9H16O2
Molecular Weight	156.2221
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:55:57 GMT 2023` Edited by `admin` on `Sat Dec 16 09:55:57 GMT 2023`
Record UNII	XYH9LG7DSY
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYL (E)-2-HEPTENOATE

Systematic Name

English

2-HEPTENOIC ACID, ETHYL ESTER, (E)-

Systematic Name

English

NSC-244958

Code

English

ETHYL HEPT-2-ENOATE

Systematic Name

English

ETHYL 2-HEPTENOATE

Systematic Name

English

2-HEPTENOIC ACID, ETHYL ESTER

Systematic Name

English

ETHYL TRANS-2-HEPTENOATE

Systematic Name

English

(E)-ETHYL 2-HEPTENOATE

Systematic Name

English

2-HEPTENOIC ACID, ETHYL ESTER, (2E)-

Systematic Name

English

Code System Code Type Description

CHEBI

87688

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

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PUBCHEM

5358363

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

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CAS

54340-72-6

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

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CAS

2351-88-4

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

XYH9LG7DSY

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

PRIMARY

EPA CompTox

DTXSID70866418

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

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NSC

244958

Created by admin on Sat Dec 16 09:55:57 GMT 2023 , Edited by admin on Sat Dec 16 09:55:57 GMT 2023

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