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Details

Stereochemistry ACHIRAL
Molecular Formula C9H20
Molecular Weight 128.2551
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-DIMETHYLHEPTANE

SMILES

CC(C)CCCC(C)C

InChI

InChIKey=KBPCCVWUMVGXGF-UHFFFAOYSA-N
InChI=1S/C9H20/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C9H20
Molecular Weight 128.2551
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 Tue Apr 01 20:11:02 GMT 2025
Edited
by admin
on Tue Apr 01 20:11:02 GMT 2025
Record UNII
M57QXT22WE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEPTANE, 2,6-DIMETHYL-
Preferred Name English
2,6-DIMETHYLHEPTANE
Systematic Name English
Code System Code Type Description
PUBCHEM
14069
Created by admin on Tue Apr 01 20:11:02 GMT 2025 , Edited by admin on Tue Apr 01 20:11:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID70147931
Created by admin on Tue Apr 01 20:11:02 GMT 2025 , Edited by admin on Tue Apr 01 20:11:02 GMT 2025
PRIMARY
FDA UNII
M57QXT22WE
Created by admin on Tue Apr 01 20:11:02 GMT 2025 , Edited by admin on Tue Apr 01 20:11:02 GMT 2025
PRIMARY
CAS
1072-05-5
Created by admin on Tue Apr 01 20:11:02 GMT 2025 , Edited by admin on Tue Apr 01 20:11:02 GMT 2025
PRIMARY