CAS: 1552-12-1
Name: cycloocta-1,5-diene
SMILES:
C1CC=CCCC=C1Molecular Processing
Molecular formula
C8H12
Molecular weight
108.18
Exact mass
108.0939
XLogP
2.67
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
36.75
Supplementary Information
InChIKey: VYXHVRARDIDEHS-UHFFFAOYSA-N
Synonyme
cis,cis-1,5-Cyclooctadiene1552-12-11,5cyclooctadieneSCHEMBL24014SCHEMBL835704SCHEMBL83629426353-15-1
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