6-tert-butylnaphthalene-2,3-dicarbonitrile

6-tert-butylnaphthalene-2,3-dicarbonitrile

CAS: 32703-82-5

Formula: C16H14N2

SMILES: CC(C)(C)C1=CC2=CC(C#N)=C(C=C2C=C1)C#N

IUPAC: 6-tert-butylnaphthalene-2,3-dicarbonitrile

InChI: InChI=1S/C16H14N2/c1-16(2,3)15-5-4-11-6-13(9-17)14(10-18)7-12(11)8-15/h4-8H,1-3H3

Composition: C (82.02%), H (6.02%), N (11.96%)

Molar Mass: 234.302

Atom Count: 32

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	234.115698459
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MKILROQBJOOZKC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.62
Topological Polar Surface Area	47.58
Polarizability	28.87
Ring Count	2
Rotatable Bond Count	1

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