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Details

Stereochemistry ACHIRAL
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2-DIETHYLHEXANOIC ACID

SMILES

CCCCC(CC)(CC)C(O)=O

InChI

InChIKey=IMHQFVGHBDXALM-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-4-7-8-10(5-2,6-3)9(11)12/h4-8H2,1-3H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C10H20O2
Molecular Weight 172.2646
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:57:51 GMT 2023
Edited
by admin
on Sat Dec 16 09:57:51 GMT 2023
Record UNII
98T349YMJT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2-DIETHYLHEXANOIC ACID
Systematic Name English
NSC-467
Code English
HEXANOIC ACID, 2,2-DIETHYL-
Common Name English
.ALPHA.,.ALPHA.-DIETHYLCAPROIC ACID
Systematic Name English
CAPROIC ACID, .ALPHA.,.ALPHA.-DIETHYL-
Common Name English
Code System Code Type Description
CAS
4528-37-4
Created by admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID7058383
Created by admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
PRIMARY
PUBCHEM
219314
Created by admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
PRIMARY
FDA UNII
98T349YMJT
Created by admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
PRIMARY
NSC
467
Created by admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
PRIMARY