C1=CC(=C(C=C1O)C(=O)O)[O-]
CAS: 490-80-2
Name: 2-carboxy-4-hydroxyphenolate
SMILES: C1=CC(=C(C=C1O)C(=O)O)[O-]

Molecular Processing

Molecular formula
C7H5O4-
Molecular weight
153.11
Exact mass
153.0193
XLogP
0.16
TPSA
80.59
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
-1
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
34.51

Supplementary Information

InChIKey: WXTMDXOMEHJXQO-UHFFFAOYSA-M
Synonyme
2,5-Dihydroxybenzoate5-hydroxysalicylateGentisateCHEBI:58044RefChem:1060090490-80-22-carboxy-4-hydroxyphenolateHydroquinonecarboxylateBenzoic acid, 2,5-dihydroxy-, ion(1-)4e3d2,5-dihydroxybenzoate anionDTXSID30197659WXTMDXOMEHJXQO-UHFFFAOYSA-MAKOS022141719Q27125148
Quelle anzeigen →
An 4 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→