4-[(2-chloro-4-fluorophenyl)methoxy]-3-ethoxybenzaldehyde

4-[(2-chloro-4-fluorophenyl)methoxy]-3-ethoxybenzaldehyde

CAS: 588713-64-8

Formula: C16H14ClFO3

SMILES: CCOC1=C(OCC2=C(Cl)C=C(F)C=C2)C=CC(C=O)=C1

IUPAC: 4-[(2-chloro-4-fluorophenyl)methoxy]-3-ethoxybenzaldehyde

InChI: InChI=1S/C16H14ClFO3/c1-2-20-16-7-11(9-19)3-6-15(16)21-10-12-4-5-13(18)8-14(12)17/h3-9H,2,10H2,1H3

Composition: C (62.25%), H (4.57%), Cl (11.48%), F (6.15%), O (15.55%)

Molar Mass: 308.73

Atom Count: 35

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	308.0615502
Formal Charge	0
FSP3	0.19
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	UDQMSQKCINBGRF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.95
Topological Polar Surface Area	35.53
Polarizability	30.27
Ring Count	2
Rotatable Bond Count	6

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