2,2,3-trimethyl-3-(1H-1,2,3,4-tetrazol-5-yl)butanenitrile

2,2,3-trimethyl-3-(1H-1,2,3,4-tetrazol-5-yl)butanenitrile

Formula: C8H13N5

SMILES: CC(C)(C#N)C(C)(C)C1=NN=NN1

IUPAC: 2,2,3-trimethyl-3-(1H-1,2,3,4-tetrazol-5-yl)butanenitrile

InChI: InChI=1S/C8H13N5/c1-7(2,5-9)8(3,4)6-10-12-13-11-6/h1-4H3,(H,10,11,12,13)

Composition: C (53.61%), H (7.31%), N (39.08%)

Molar Mass: 179.227

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	179.117095439
Formal Charge	0
FSP3	0.75
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	XTTUDGKWTOHWNT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.78
Topological Polar Surface Area	78.25
Polarizability	18.16
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C8H13N5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00