4-(trifluoromethyl)-2H-1,2,3-triazole

4-(trifluoromethyl)-2H-1,2,3-triazole

CAS: 40964-54-3

Formula: C3H2F3N3

SMILES: FC(F)(F)C1=NNN=C1

IUPAC: 4-(trifluoromethyl)-2H-1,2,3-triazole

InChI: InChI=1S/C3H2F3N3/c4-3(5,6)2-1-7-9-8-2/h1H,(H,7,8,9)

Composition: C (26.29%), H (1.47%), F (41.58%), N (30.66%)

Molar Mass: 137.065

Atom Count: 11

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	137.020081565
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DIBFBUQGVMZWTM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	24.28
Topological Polar Surface Area	41.57
Polarizability	7.98
Ring Count	1
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	40964-54-3		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	40964-54-3		$149.04-$838.35$149.04$273.24$838.35

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	40964-54-3		$174.80$174.80

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	40964-54-3		$886.00$886.00