2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanedinitrile

2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanedinitrile

CAS: 23051-44-7

Formula: C12H14N2

SMILES: CC1=CC(CC(C)(C)C1)=C(C#N)C#N

IUPAC: 2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanedinitrile

InChI: InChI=1S/C12H14N2/c1-9-4-10(11(7-13)8-14)6-12(2,3)5-9/h4H,5-6H2,1-3H3

Composition: C (77.38%), H (7.58%), N (15.04%)

Molar Mass: 186.258

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	186.115698459
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QTUUBOZSGQFLRZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.7
Topological Polar Surface Area	47.58
Polarizability	21.31
Ring Count	1
Rotatable Bond Count	0

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