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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O
Molecular Weight 126.1962
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2-Dimethylcyclohexanone

SMILES

CC1(C)CCCCC1=O

InChI

InChIKey=KNSPBSQWRKKAPI-UHFFFAOYSA-N
InChI=1S/C8H14O/c1-8(2)6-4-3-5-7(8)9/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H14O
Molecular Weight 126.1962
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:27:24 GMT 2023
Edited
by admin
on Sat Dec 16 19:27:24 GMT 2023
Record UNII
JP29SV6ZY9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2-Dimethylcyclohexanone
Systematic Name English
NSC-20553
Code English
2,2-Dimethylcyclohexan-1-one
Systematic Name English
2,2-Dimethyl-1-cyclohexanone
Systematic Name English
Cyclohexanone, 2,2-dimethyl-
Systematic Name English
Code System Code Type Description
CAS
1193-47-1
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
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PUBCHEM
136929
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
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NSC
20553
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID30870859
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
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FDA UNII
JP29SV6ZY9
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
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