N-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide

N-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide

CAS: 2379944-72-4

Formula: C6H6F3N3O

SMILES: CNC(=O)C1=CNN=C1C(F)(F)F

IUPAC: N-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide

InChI: InChI=1S/C6H6F3N3O/c1-10-5(13)3-2-11-12-4(3)6(7,8)9/h2H,1H3,(H,10,13)(H,11,12)

Composition: C (37.31%), H (3.13%), F (29.51%), N (21.76%), O (8.28%)

Molar Mass: 193.129

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.046296314
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	IKVSNIBWNAPJFM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.32
Topological Polar Surface Area	57.78
Polarizability	13.41
Ring Count	1
Rotatable Bond Count	2

Suppliers

Crea-Chim UAB

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	2379944-72-4		$322.40$322.40