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5-(aminomethyl)thiophene-2-carbonitrile

5-(aminomethyl)thiophene-2-carbonitrile

CAS: 227279-10-9

Formula: C6H6N2S

SMILES: NCC1=CC=C(S1)C#N

IUPAC: 5-(aminomethyl)thiophene-2-carbonitrile

InChI: InChI=1S/C6H6N2S/c7-3-5-1-2-6(4-8)9-5/h1-2H,3,7H2

Composition: C (52.15%), H (4.38%), N (20.27%), S (23.20%)

Molar Mass: 138.19

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 138.025169375
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey FHYNZXSHHPBOBK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.93
Topological Polar Surface Area 49.81
Polarizability 14.2
Ring Count 1
Rotatable Bond Count 1

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96% <2 Days 227279-10-9 $124.20-$3,447.70$124.20$143.75$171.35$227.70$917.70$3,447.70
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