6-amino-4-(trifluoromethyl)pyridine-3-carbaldehyde

6-amino-4-(trifluoromethyl)pyridine-3-carbaldehyde

CAS: 1289102-99-3

Formula: C7H5F3N2O

SMILES: NC1=CC(=C(C=O)C=N1)C(F)(F)F

IUPAC: 6-amino-4-(trifluoromethyl)pyridine-3-carbaldehyde

InChI: InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-6(11)12-2-4(5)3-13/h1-3H,(H2,11,12)

Composition: C (44.22%), H (2.65%), F (29.98%), N (14.73%), O (8.41%)

Molar Mass: 190.125

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	190.035397278
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CRCWQWXTXUYZRI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.47
Topological Polar Surface Area	55.98
Polarizability	13.88
Ring Count	1
Rotatable Bond Count	2

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