CC1=C(C=CC(=C1)OCCOCC2CC2)O
Nombre: 4-[2-(cyclopropylmethoxy)ethoxy]-2-methylphenol
SMILES: CC1=C(C=CC(=C1)OCCOCC2CC2)O

Molecular Processing

Molecular formula
C13H18O3
Molecular weight
222.28
Exact mass
222.1256
XLogP
2.51
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
61.88

Supplementary Information

InChIKey: YKVUKYBTNPGDSD-UHFFFAOYSA-N
Sinónimos
SCHEMBL9559103YKVUKYBTNPGDSD-UHFFFAOYSA-N4-(2-(cyclopropylmethoxy)ethoxy)-2-methylphenol
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