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5-(4-methoxyphenyl)thiophene-2-carboxylic acid

5-(4-methoxyphenyl)thiophene-2-carboxylic acid

CAS: 116016-56-9

Formula: C12H10O3S

SMILES: COC1=CC=C(C=C1)C1=CC=C(S1)C(O)=O

IUPAC: 5-(4-methoxyphenyl)thiophene-2-carboxylic acid

InChI: InChI=1S/C12H10O3S/c1-15-9-4-2-8(3-5-9)10-6-7-11(16-10)12(13)14/h2-7H,1H3,(H,13,14)

Composition: C (61.52%), H (4.30%), O (20.49%), S (13.69%)

Molar Mass: 234.27

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 234.035065356
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XLTXZWKQUHETLK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.59
Topological Polar Surface Area 46.53
Polarizability 24.79
Ring Count 2
Rotatable Bond Count 3

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Key Organics Ltd
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 116016-56-9 $51.35-$674.07$51.35$63.37$86.31$143.12$225.06$674.07
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% <7 Days 116016-56-9 $172.85-$1,126.08$172.85$256.68$435.74$1,126.08
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AA BLOCKS INC
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Purity LeadTime CAS PacketSize UnitPrice
% <6 Days 116016-56-9 $72.45-$764.75$72.45$133.40$263.35$764.75
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