C#CCOCC#C
Name: propargyl-ether
SMILES: C#CCOCC#C

Molecular Processing

Molecular formula
C6H6O
Molecular weight
94.11
Exact mass
94.0419
XLogP
0.27
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
28.48

Supplementary Information

Details werden geladen…

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