5-tert-butylpyrazine-2,3-dicarbonitrile

5-tert-butylpyrazine-2,3-dicarbonitrile

CAS: 51440-69-8

Formula: C10H10N4

SMILES: CC(C)(C)C1=NC(C#N)=C(N=C1)C#N

IUPAC: 5-tert-butylpyrazine-2,3-dicarbonitrile

InChI: InChI=1S/C10H10N4/c1-10(2,3)9-6-13-7(4-11)8(5-12)14-9/h6H,1-3H3

Composition: C (64.50%), H (5.41%), N (30.09%)

Molar Mass: 186.218

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	186.090546338
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	DMBXBPQXFZRCIT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.74
Topological Polar Surface Area	73.36
Polarizability	19.51
Ring Count	1
Rotatable Bond Count	1

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