TERPINYL ISOBUTYRATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H24O2
Molecular Weight	224.3392
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TERPINYL ISOBUTYRATE

Structure Search

SMILES

CC(C)C(=O)OC(C)(C)C1CCC(C)=CC1

InChI

InChIKey=SMQUXKIIXFOJKI-UHFFFAOYSA-N

InChI=1S/C14H24O2/c1-10(2)13(15)16-14(4,5)12-8-6-11(3)7-9-12/h6,10,12H,7-9H2,1-5H3

HIDE SMILES / InChI

Molecular Formula	C14H24O2
Molecular Weight	224.3392
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 `Sat Dec 16 00:18:06 GMT 2023` Edited by `admin` on `Sat Dec 16 00:18:06 GMT 2023`
Record UNII	Z55SZR66DG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TERPINYL ISOBUTYRATE

Systematic Name

English

TERPINYL ISOBUTYRATE, (±)-

Systematic Name

English

P-MENTH-1-EN-8-YL-ISOBUTYRATE, (±)-

Systematic Name

English

FEMA NO. 3050

Code

English

PROPANOIC ACID, 2-METHYL-, 1-METHYL-1-(4-METHYL-3- CYCLOHEXEN-1-YL)ETHYL ESTER

Common Name

English

P-MENTH-1-EN-8-YL-ISOBUTYRATE

Systematic Name

English

PROPANOIC ACID, 2-METHYL-, 1-METHYL-1-(4-METHYL-3-CYCLOHEXEN-1-YL)ETHYL ESTER, (±)-

Common Name

English

.ALPHA.-TERPINYL ISOBUTYRATE

Common Name

English

TERPINYL ISOBUTYRATE [FHFI]

Common Name

English

Classification Tree Code System Code

CFR

21 CFR 172.515

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

JECFA EVALUATION

TERPINYL ISOBUTYRATE

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

Code System Code Type Description

PUBCHEM

522673

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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JECFA MONOGRAPH

79

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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FDA UNII

Z55SZR66DG

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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ECHA (EC/EINECS)

231-878-5

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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EPA CompTox

DTXSID50864114

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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CAS

7774-65-4

Created by admin on Sat Dec 16 00:18:06 GMT 2023 , Edited by admin on Sat Dec 16 00:18:06 GMT 2023

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