CC(=CCOC(=O)C)CCC=C(C)CO
Nombre: (8-hydroxy-3,7-dimethylocta-2,6-dienyl) acetate
SMILES: CC(=CCOC(=O)C)CCC=C(C)CO

Molecular Processing

Molecular formula
C12H20O3
Molecular weight
212.29
Exact mass
212.1412
XLogP
2.21
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
60.47

Supplementary Information

InChIKey: HZIJXISIZGWHAY-UHFFFAOYSA-N
Sinónimos
SCHEMBL1073135SCHEMBL28410357HZIJXISIZGWHAY-UHFFFAOYSA-N8-Acetoxy-2,6-dimethyl-2,6-octadien-1-ol8-acetoxy-2,6-dimethyl-2,6-octadiene-1-ol1-acetoxy-8-hydroxy-3,7-dimethyl-octa-2,6-dien
Ver fuente →
Participa en 8 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→