C1=CC2=C(C=C1Cl)C=C(O2)C(=O)O
CAS: 10242-10-1
Nom: 5-chloro-1-benzofuran-2-carboxylic acid
SMILES: C1=CC2=C(C=C1Cl)C=C(O2)C(=O)O

Molecular Processing

Molecular formula
C9H5ClO3
Molecular weight
196.59
Exact mass
195.9927
XLogP
2.78
TPSA
50.44
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.18

Supplementary Information

InChIKey: JETRXAHRPACNMA-UHFFFAOYSA-N
Synonymes
5-chloro-1-benzofuran-2-carboxylic acid5-CHLORO-2-BENZOFURANCARBOXYLIC ACIDRefChem:534263674-048-15-Chlorobenzofuran-2-carboxylic acid10242-10-15-chlorobenzo[b]furan-2-carboxylic acid2-BENZOFURANCARBOXYLIC ACID, 5-CHLORO-MFCD000605125-Chloro-benzofuran-2-carboxylic acid5-Chlorocoumarilic Acid2-Benzofurancarboxylicacid, 5-chloro-SCHEMBL705754CHEMBL412667SCHEMBL29526778DTXSID40359089JETRXAHRPACNMA-UHFFFAOYSA-NHMS1698D07BBL009658SBB077383STK8994935-chlo-robenzofuran-2-carboxylic acidAKOS0002761535-Chlorobenzo[b]furan-2carboxylic AcidCS-W010579FS-1523MB004995-Chlorobenzo[b]furan-2 carboxylic AcidSY049517C2890
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→