5-(diethylamino)-2-[(E)-[(2-fluoro-5-nitrophenyl)imino]methyl]phenol

5-(diethylamino)-2-[(E)-[(2-fluoro-5-nitrophenyl)imino]methyl]phenol

Formula: C17H18FN3O3

SMILES: CCN(CC)C1=CC=C(C=NC2=CC(=CC=C2F)[N+]([O-])=O)C(O)=C1

IUPAC: 5-(diethylamino)-2-[(E)-[(2-fluoro-5-nitrophenyl)imino]methyl]phenol

InChI: InChI=1S/C17H18FN3O3/c1-3-20(4-2)13-6-5-12(17(22)10-13)11-19-16-9-14(21(23)24)7-8-15(16)18/h5-11,22H,3-4H2,1-2H3/b19-11+

Composition: C (61.62%), H (5.48%), F (5.73%), N (12.68%), O (14.49%)

Molar Mass: 331.347

Atom Count: 42

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	331.133219615
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XTQZXKFOKDNAJV-YBFXNURJSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.83
Topological Polar Surface Area	78.97
Polarizability	33.13
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H18FN3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00