3-Heptenyl acetate, (3E)-

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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 3-Heptenyl acetate, (3E)-

Structure Search

SMILES

CCC\C=C\CCOC(C)=O

InChI

InChIKey=AAYIYWGTGAUKQY-AATRIKPKSA-N

InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3/b6-5+

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 `Fri Dec 15 18:04:16 GMT 2023` Edited by `admin` on `Fri Dec 15 18:04:16 GMT 2023`
Record UNII	R6VN5HBW4C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Heptenyl acetate, (3E)-

Systematic Name

English

TRANS-3-HEPTENYL ACETATE [FHFI]

Common Name

English

3-HEPTEN-1-OL, ACETATE, (E)-

Systematic Name

English

3-Hepten-1-ol, acetate, (3E)-

Systematic Name

English

3-HEPTENYL ACETATE, TRANS-

Systematic Name

English

(E)-HEPT-3-ENYL ACETATE

Systematic Name

English

3-HEPTEN-1-YL ACETATE, (E)-

Systematic Name

English

3-HEPTENYL ACETATE, (E)-

Systematic Name

English

FEMA NO. 3493

Code

English

Classification Tree Code System Code

JECFA EVALUATION

TRANS-3-HEPTENYL ACETATE

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

Code System Code Type Description

ECHA (EC/EINECS)

216-411-5

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

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JECFA MONOGRAPH

243

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

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CAS

1576-77-8

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

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PUBCHEM

5363206

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

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FDA UNII

R6VN5HBW4C

Created by admin on Fri Dec 15 18:04:16 GMT 2023 , Edited by admin on Fri Dec 15 18:04:16 GMT 2023

PRIMARY