3-[1'-ethyl-5-(trifluoromethyl)-[3,4'-bipyrazol]-2-yl]propan-1-amine

3-[1'-ethyl-5-(trifluoromethyl)-[3,4'-bipyrazol]-2-yl]propan-1-amine

CAS: 1006340-97-1

Formula: C12H16F3N5

SMILES: CCN1C=C(C=N1)C1=CC(=NN1CCCN)C(F)(F)F

IUPAC: 3-[1'-ethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl]propan-1-amine

InChI: InChI=1S/C12H16F3N5/c1-2-19-8-9(7-17-19)10-6-11(12(13,14)15)18-20(10)5-3-4-16/h6-8H,2-5,16H2,1H3

Composition: C (50.17%), H (5.61%), F (19.84%), N (24.38%)

Molar Mass: 287.29

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	287.135780024
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WMLJRWMXIIOGEL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.04
Topological Polar Surface Area	61.66
Polarizability	26.52
Ring Count	2
Rotatable Bond Count	6

Suppliers

Crea-Chim UAB

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	1006340-97-1		$187.20$187.20