2-TERT-BUTYLCYCLOHEXYL ACETATE, CIS-

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H22O2
Molecular Weight	198.3019
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-TERT-BUTYLCYCLOHEXYL ACETATE, CIS-

Structure Search

SMILES

CC(=O)O[C@H]1CCCC[C@H]1C(C)(C)C

InChI

InChIKey=FINOAUDUYKVGDS-MNOVXSKESA-N

InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C12H22O2
Molecular Weight	198.3019
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:07:17 GMT 2023` Edited by `admin` on `Sat Dec 16 01:07:17 GMT 2023`
Record UNII	87JN7005XU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-TERT-BUTYLCYCLOHEXYL ACETATE, CIS-

Systematic Name

English

CYCLOHEXANOL, 2-(1,1-DIMETHYLETHYL)-, ACETATE, CIS-

Systematic Name

English

CYCLOHEXANOL, 2-(1,1-DIMETHYLETHYL)-, 1-ACETATE, (1R,2R)-REL-

Common Name

English

CYCLOHEXANOL, 2-TERT-BUTYL-, ACETATE, CIS-

Systematic Name

English

CIS-2-TERT-BUTYLCYCLOHEXYL ACETATE

Systematic Name

English

CYCLOHEXANOL, 2-(1,1-DIMETHYLETHYL)-, ACETATE, (1R,2R)-REL-

Common Name

English

Code System Code Type Description

RXCUI

2604560

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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PUBCHEM

21116400

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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DAILYMED

87JN7005XU

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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ECHA (EC/EINECS)

243-718-1

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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CAS

20298-69-5

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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FDA UNII

87JN7005XU

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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EPA CompTox

DTXSID2051845

Created by admin on Sat Dec 16 01:07:17 GMT 2023 , Edited by admin on Sat Dec 16 01:07:17 GMT 2023

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