O=C(O)CCCOCc1ccccc1
CAS: 10385-30-5
Nom: 4-phenylmethoxybutanoic acid
SMILES: O=C(O)CCCOCc1ccccc1

Molecular Processing

Molecular formula
C11H14O3
Molecular weight
194.23
Exact mass
194.0943
XLogP
2.07
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
52.97

Supplementary Information

InChIKey: CXEFZVVLTJQWBF-UHFFFAOYSA-N
Synonymes
4-(Benzyloxy)butanoic acid10385-30-5DTXSID30340163RefChem:515254DTXCID50291244628-164-44-Benzyloxybutyric acid4-phenylmethoxybutanoic acid4-(benzyloxy)butyric acidButanoic acid, 4-(phenylmethoxy)-MFCD013212574-Benzyloxybutanoic AcidButyric acid, 4-(benzyloxy)-4-(Benzyloxy)butanoicacid4-Benzyloxy-butyric acidSCHEMBL2911944-(Benzyloxy)butanoic acid #4-Benzyloxybutyric acid, 95%AKOS000187756CS-W022004GS-3789FB153540SY029101EN300-60882F210237Z316258810
Voir la source →
Impliqué dans 23 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→