BORNYL ACETATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H20O2
Molecular Weight	196.286
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BORNYL ACETATE

Structure Search

SMILES

[H][C@]12CC[C@](C)([C@@H](C1)OC(C)=O)C2(C)C

InChI

InChIKey=KGEKLUUHTZCSIP-HOSYDEDBSA-N

InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C12H20O2
Molecular Weight	196.286
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:04:29 UTC 2023` Edited by `admin` on `Fri Dec 15 15:04:29 UTC 2023`
Record UNII	213431586X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BORNYL ACETATE

Official Name

English

BICYCLO(2.2.1)HEPTAN-2-OL, 1,7,7-TRIMETHYL-, 2-ACETATE, (1R,2S,4R)-REL-

Common Name

English

BORNYL ACETATE [USAN]

Common Name

English

NEOL ACETATE

Common Name

English

(±)-BORNYL ACETATE

Systematic Name

English

NSC-407158

Code

English

BORNYL ACETATE [INCI]

Common Name

English

BORNYL ACETATE [FHFI]

Common Name

English

FEMA NO. 2159

Code

English

BORNYL ACETATE [MART.]

Common Name

English

BORNYL ACETATE [MI]

Common Name

English

BORNYL ACETATE [FCC]

Common Name

English

BORNYLACETATE

Systematic Name

English

DL-BORNYL ACETATE

Common Name

English

BICYCLO(2.2.1)HEPTAN-2-OL, 1,7,7-TRIMETHYL-, ACETATE, ENDO-

Common Name

English

ENDO-BORNYL ACETATE

Common Name

English

BORNYL ACETATE (CONSTITUENT OF CHAMOMILE) [DSC]

Common Name

English

Bornyl acetate [WHO-DD]

Common Name

English

1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-OL ACETATE

Systematic Name

English

BICYCLO(2.2.1)HEPTAN-2-OL, 1,7,7-TRIMETHYL-, ACETATE, (1R,2S,4R)-REL-

Common Name

English

(1R,2S,4R)-REL-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-OL 2-ACETATE

Common Name

English

ENDO-1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL ACETATE

Common Name

English

BORNEOL ACETATE

Systematic Name

English

Classification Tree Code System Code

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

EPA PESTICIDE CODE

67210

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

JECFA EVALUATION

BORNYL ACETATE

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

Code System Code Type Description

JECFA MONOGRAPH

1386

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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FDA UNII

213431586X

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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MESH

C071528

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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ChEMBL

CHEMBL2106026

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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NCI_THESAURUS

C142964

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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ECHA (EC/EINECS)

200-964-4

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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EPA CompTox

DTXSID7041675

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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RXCUI

1491978

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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RxNorm

CAS

76-49-3

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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WIKIPEDIA

Bornyl acetate

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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SMS_ID

100000076897

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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MERCK INDEX

m2611

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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Merck Index

NCI_THESAURUS

C45678

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

CONCEPT

Industrial Aid

EVMPD

SUB13114MIG

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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DRUG BANK

DB14665

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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NSC

407158

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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DAILYMED

213431586X

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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PUBCHEM

93009

Created by admin on Fri Dec 15 15:04:30 UTC 2023 , Edited by admin on Fri Dec 15 15:04:30 UTC 2023

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