C1C2C(O2)COC1C(C3=CC=CC=C3)C4=CC=CC=C4
Name: (1S,4S,6R)-4-benzhydryl-3,7-dioxabicyclo[4.1.0]heptane
SMILES: C1C2C(O2)COC1C(C3=CC=CC=C3)C4=CC=CC=C4

Molecular Processing

Molecular formula
C18H18O2
Molecular weight
266.34
Exact mass
266.1307
XLogP
3.37
TPSA
21.76
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
77.75

Supplementary Information

InChIKey: DUEQWSFFKLBHLL-IKGGRYGDSA-N
Synonyme
SCHEMBL245152DUEQWSFFKLBHLL-IKGGRYGDSA-N(1S,4S,6R)-4-benzhydryl-3,7-dioxa-bicyclo[4.1.0]-heptane(1S, 4S, 6R)-4-benzhydryl-3,7-dioxa-bicyclo[4.1.0]-heptane
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