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Details

Stereochemistry RACEMIC
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-TERT-BUTYLCYCLOHEXANONE

SMILES

CC(C)(C)C1CCCCC1=O

InChI

InChIKey=ZRYDPLOWJSFQAE-UHFFFAOYSA-N
InChI=1S/C10H18O/c1-10(2,3)8-6-4-5-7-9(8)11/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H18O
Molecular Weight 154.2493
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Biologically active contaminants of intravenous saline in PVC packaging: Australasian, European, and North American samples.
2005 Feb
Asymmetric solid-phase alkylation of ketones immobilized via SAMP hydrazone analogue linkers.
2008 Nov-Dec
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:36:08 GMT 2023
Edited
by admin
on Sat Dec 16 01:36:08 GMT 2023
Record UNII
TEC7LUO1VP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-TERT-BUTYLCYCLOHEXANONE
Systematic Name English
VERDONE
Common Name English
O-TERT-BUTYLCYCLOHEXANONE
Common Name English
CYCLOHEXANONE, 2-(1,1-DIMETHYLETHYL)-
Systematic Name English
CYCLOHEXANONE, 2-TERT-BUTYL-
Systematic Name English
2-(1,1-DIMETHYLETHYL)CYCLOHEXANONE
Systematic Name English
J150.046E
Code English
(±)-2-TERT-BUTYLCYCLOHEXANONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID5047081
Created by admin on Sat Dec 16 01:36:09 GMT 2023 , Edited by admin on Sat Dec 16 01:36:09 GMT 2023
PRIMARY
FDA UNII
TEC7LUO1VP
Created by admin on Sat Dec 16 01:36:09 GMT 2023 , Edited by admin on Sat Dec 16 01:36:09 GMT 2023
PRIMARY
CAS
1728-46-7
Created by admin on Sat Dec 16 01:36:09 GMT 2023 , Edited by admin on Sat Dec 16 01:36:09 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-043-8
Created by admin on Sat Dec 16 01:36:09 GMT 2023 , Edited by admin on Sat Dec 16 01:36:09 GMT 2023
PRIMARY
PUBCHEM
102681
Created by admin on Sat Dec 16 01:36:09 GMT 2023 , Edited by admin on Sat Dec 16 01:36:09 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE