2-ethoxy-4-fluorobenzoic acid

2-ethoxy-4-fluorobenzoic acid

CAS: 1233541-55-3

Formula: C9H9FO3

SMILES: CCOC1=CC(F)=CC=C1C(O)=O

IUPAC: 2-ethoxy-4-fluorobenzoic acid

InChI: InChI=1S/C9H9FO3/c1-2-13-8-5-6(10)3-4-7(8)9(11)12/h3-5H,2H2,1H3,(H,11,12)

Composition: C (58.70%), H (4.93%), F (10.32%), O (26.06%)

Molar Mass: 184.166

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	184.053572313
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WHVUGPXBYGXZCU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.74
Topological Polar Surface Area	46.53
Polarizability	16.79
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1233541-55-3		$104.66-$1,172.73$104.66$250.94$1,172.73