ethyl 4-amino-2,6-difluorobenzoate

ethyl 4-amino-2,6-difluorobenzoate

CAS: 191469-36-0

Formula: C9H9F2NO2

SMILES: CCOC(=O)C1=C(F)C=C(N)C=C1F

IUPAC: ethyl 4-amino-2,6-difluorobenzoate

InChI: InChI=1S/C9H9F2NO2/c1-2-14-9(13)8-6(10)3-5(12)4-7(8)11/h3-4H,2,12H2,1H3

Composition: C (53.73%), H (4.51%), F (18.89%), N (6.96%), O (15.91%)

Molar Mass: 201.173

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	201.06013486
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UNWQLHONIWEPMU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.97
Topological Polar Surface Area	52.32
Polarizability	17.26
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<14 Days	191469-36-0		$147.42-$552.83$147.42$552.83