CCOC(=O)C1CC1C2=C(C(=C(C=C2)O)C)C
Название: ethyl 2-(4-hydroxy-2,3-dimethylphenyl)cyclopropane-1-carboxylate
SMILES: CCOC(=O)C1CC1C2=C(C(=C(C=C2)O)C)C

Molecular Processing

Molecular formula
C14H18O3
Molecular weight
234.29
Exact mass
234.1256
XLogP
2.68
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
65.06

Supplementary Information

InChIKey: WZGXLHJPOKPPIP-UHFFFAOYSA-N
Синонимы
SCHEMBL15668675WZGXLHJPOKPPIP-UHFFFAOYSA-N2-(4-hydroxy-2,3-dimethyl-phenyl)-cyclopropane carboxylic acid ethyl ester2-(4-hydroxy-2,3-dimethyl-phenyl)-cyclopropanecarboxylic acid ethyl ester
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