ISOPROPYL TIGLATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H14O2
Molecular Weight	142.1956
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ISOPROPYL TIGLATE

Structure Search

SMILES

C\C=C(/C)C(=O)OC(C)C

InChI

InChIKey=VUPBIVVRPJDWNW-FNORWQNLSA-N

InChI=1S/C8H14O2/c1-5-7(4)8(9)10-6(2)3/h5-6H,1-4H3/b7-5+

HIDE SMILES / InChI

Molecular Formula	C8H14O2
Molecular Weight	142.1956
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 18:16:45 GMT 2023` Edited by `admin` on `Fri Dec 15 18:16:45 GMT 2023`
Record UNII	50936QM86D
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ISOPROPYL TIGLATE

Systematic Name

English

2-BUTENOIC ACID, 2-METHYL-, 1-METHYLETHYL ESTER, (E)-

Common Name

English

TIGLIC ACID ISOPROPYL ESTER

Systematic Name

English

FEMA NO. 3229

Code

English

2-BUTENOIC ACID, 2-METHYL-, 1-METHYLETHYL ESTER, (2E)-

Common Name

English

ISOPROPYL TIGLATE [FHFI]

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

ISOPROPYL TIGLATE

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

Code System Code Type Description

JECFA MONOGRAPH

376

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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CAS

1733-25-1

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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FDA UNII

50936QM86D

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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EPA CompTox

DTXSID70883746

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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ECHA (EC/EINECS)

217-067-9

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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PUBCHEM

5367745

Created by admin on Fri Dec 15 18:16:45 GMT 2023 , Edited by admin on Fri Dec 15 18:16:45 GMT 2023

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