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5-(methylsulfanyl)thiophene-2-carbaldehyde

5-(methylsulfanyl)thiophene-2-carbaldehyde

CAS: 24445-35-0

Formula: C6H6OS2

SMILES: CSC1=CC=C(S1)C=O

IUPAC: 5-(methylsulfanyl)thiophene-2-carbaldehyde

InChI: InChI=1S/C6H6OS2/c1-8-6-3-2-5(4-7)9-6/h2-4H,1H3

Composition: C (45.54%), H (3.82%), O (10.11%), S (40.52%)

Molar Mass: 158.23

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 157.986007161
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey RKXYTFTZODXDEF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.45
Topological Polar Surface Area 17.07
Polarizability 15.81
Ring Count 1
Rotatable Bond Count 2

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