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4-ethynylthiophene-2-carbaldehyde

4-ethynylthiophene-2-carbaldehyde

CAS: 913828-75-8

Formula: C7H4OS

SMILES: O=CC1=CC(=CS1)C#C

IUPAC: 4-ethynylthiophene-2-carbaldehyde

InChI: InChI=1S/C7H4OS/c1-2-6-3-7(4-8)9-5-6/h1,3-5H

Composition: C (61.75%), H (2.96%), O (11.75%), S (23.54%)

Molar Mass: 136.17

Atom Count: 13

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 135.998285923
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey KLJYDZXBWYSFCT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.7
Topological Polar Surface Area 17.07
Polarizability 13.48
Ring Count 1
Rotatable Bond Count 1

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95% <7 Days 913828-75-8 $104.54-$427.46$104.54$189.41$427.46
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