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Details

Stereochemistry ACHIRAL
Molecular Formula C12H18
Molecular Weight 162.2713
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXAN-3-YLBENZENE

SMILES

CCCC(CC)C1=CC=CC=C1

InChI

InChIKey=SLVCCWGFGQVDMN-UHFFFAOYSA-N
InChI=1S/C12H18/c1-3-8-11(4-2)12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H18
Molecular Weight 162.2713
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
KIQ0N3DUG5
Record Status Validated (UNII)
Record Version