ethyl 2-fluoro-4-iodobenzoate

ethyl 2-fluoro-4-iodobenzoate

CAS: 205750-82-9

Formula: C9H8FIO2

SMILES: CCOC(=O)C1=C(F)C=C(I)C=C1

IUPAC: ethyl 2-fluoro-4-iodobenzoate

InChI: InChI=1S/C9H8FIO2/c1-2-13-9(12)7-4-3-6(11)5-8(7)10/h3-5H,2H2,1H3

Composition: C (36.76%), H (2.74%), F (6.46%), I (43.16%), O (10.88%)

Molar Mass: 294.064

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	293.9553
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ZXUWYQWFYLDBII-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.41
Topological Polar Surface Area	26.3
Polarizability	21.65
Ring Count	1
Rotatable Bond Count	3

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