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3-ethoxythiophene-2-carboxylic acid

3-ethoxythiophene-2-carboxylic acid

CAS: 139926-23-1

Formula: C7H8O3S

SMILES: CCOC1=C(SC=C1)C(O)=O

IUPAC: 3-ethoxythiophene-2-carboxylic acid

InChI: InChI=1S/C7H8O3S/c1-2-10-5-3-4-11-6(5)7(8)9/h3-4H,2H2,1H3,(H,8,9)

Composition: C (48.83%), H (4.68%), O (27.87%), S (18.62%)

Molar Mass: 172.2

Atom Count: 19

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 172.019415292
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FTKDCOINUAYGTC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.42
Topological Polar Surface Area 46.53
Polarizability 15.79
Ring Count 1
Rotatable Bond Count 3

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90% <2 Days 139926-23-1 $51.35-$86.31$51.35$63.37$86.31
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