الاسم: 2-(3,4-methylenedioxyphenyl)ethyl 1-methylcyclopropyl carbinol
SMILES:
CC1(C(O)CCc2ccc3c(c2)OCO3)CC1Molecular Processing
Molecular formula
C14H18O3
Molecular weight
234.29
Exact mass
234.1256
XLogP
2.51
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
64.23
Supplementary Information
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