الاسم: 6-butyl-7-methoxy-5H-cyclopenta[f][1,3]benzodioxole
SMILES:
CCCCC1=C(C2=CC3=C(C=C2C1)OCO3)OCMolecular Processing
Molecular formula
C15H18O3
Molecular weight
246.31
Exact mass
246.1256
XLogP
3.52
TPSA
27.69
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
69.72
Supplementary Information
InChIKey: UDGVKXHVBXZSJD-UHFFFAOYSA-N
مرادفات
SCHEMBL9666503UDGVKXHVBXZSJD-UHFFFAOYSA-N2-n-butyl-3-methoxy-5,6-methylenedioxyindene
مشارك في 5 تفاعل→