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Details

Stereochemistry ACHIRAL
Molecular Formula C8H18
Molecular Weight 114.2285
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHYLHEXANE

SMILES

CCCC(CC)CC

InChI

InChIKey=SFRKSDZMZHIISH-UHFFFAOYSA-N
InChI=1S/C8H18/c1-4-7-8(5-2)6-3/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H18
Molecular Weight 114.2285
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 13:25:13 GMT 2023
Edited
by admin
on Sat Dec 16 13:25:13 GMT 2023
Record UNII
8JH9HL7N4H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ETHYLHEXANE
Systematic Name English
NSC-74175
Code English
1,1-DIETHYLBUTANE
Systematic Name English
Code System Code Type Description
NSC
74175
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY
CAS
619-99-8
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY
PUBCHEM
12096
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID6060713
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-621-0
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY
FDA UNII
8JH9HL7N4H
Created by admin on Sat Dec 16 13:25:13 GMT 2023 , Edited by admin on Sat Dec 16 13:25:13 GMT 2023
PRIMARY