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7-methoxy-1-benzofuran-3-carboxylic acid

7-methoxy-1-benzofuran-3-carboxylic acid

CAS: 344287-58-7

Formula: C10H8O4

SMILES: COC1=C2OC=C(C(O)=O)C2=CC=C1

IUPAC: 7-methoxy-1-benzofuran-3-carboxylic acid

InChI: InChI=1S/C10H8O4/c1-13-8-4-2-3-6-7(10(11)12)5-14-9(6)8/h2-5H,1H3,(H,11,12)

Composition: C (62.50%), H (4.20%), O (33.30%)

Molar Mass: 192.17

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 192.042258738
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LBIXZQALKDMTIT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.62
Topological Polar Surface Area 59.67
Polarizability 19.57
Ring Count 2
Rotatable Bond Count 2

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