3,3-difluoro-1-(1H-1,2,3-triazol-4-yl)cyclobutan-1-amine dihydrochloride

3,3-difluoro-1-(1H-1,2,3-triazol-4-yl)cyclobutan-1-amine dihydrochloride

CAS: 2316459-16-0

Formula: C6H10Cl2F2N4

SMILES: Cl.Cl.NC1(CC(F)(F)C1)C1=CNN=N1

IUPAC: 3,3-difluoro-1-(1H-1,2,3-triazol-4-yl)cyclobutan-1-amine dihydrochloride

InChI: InChI=1S/C6H8F2N4.2ClH/c7-6(8)2-5(9,3-6)4-1-10-12-11-4;;/h1H,2-3,9H2,(H,10,11,12);2*1H

Composition: C (29.17%), H (4.08%), Cl (28.70%), F (15.38%), N (22.68%)

Molar Mass: 247.07

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	246.0250581
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	JUBOFPRGGADZHT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.37
Topological Polar Surface Area	67.59
Polarizability	14.09
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2316459-16-0		$268.59-$1,104.64$268.59$428.74$737.69$1,104.64