4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde

4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde

CAS: 102808-02-6

Formula: C5H3F3N2O

SMILES: FC(F)(F)C1=CNC(C=O)=N1

IUPAC: 4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde

InChI: InChI=1S/C5H3F3N2O/c6-5(7,8)3-1-9-4(2-11)10-3/h1-2H,(H,9,10)

Composition: C (36.60%), H (1.84%), F (34.73%), N (17.07%), O (9.75%)

Molar Mass: 164.087

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	164.019747214
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FYKPCRCNMFOTHP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.66
Topological Polar Surface Area	45.75
Polarizability	10.66
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	102808-02-6		$97.10-$354.34$97.10$142.49$354.34