COC(=O)C(C)(C)c1ccc(C(=O)O)cc1
SMILES: COC(=O)C(C)(C)c1ccc(C(=O)O)cc1

Molecular Processing

Molecular formula
C12H14O4
Molecular weight
222.24
Exact mass
222.0892
XLogP
1.84
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
58.44

Supplementary Information

Details werden geladen…

An 6 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→