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2-fluoro-3-hydroxy-4-methoxybenzaldehyde

2-fluoro-3-hydroxy-4-methoxybenzaldehyde

CAS: 79418-73-8

Formula: C8H7FO3

SMILES: COC1=C(O)C(F)=C(C=O)C=C1

IUPAC: 2-fluoro-3-hydroxy-4-methoxybenzaldehyde

InChI: InChI=1S/C8H7FO3/c1-12-6-3-2-5(4-10)7(9)8(6)11/h2-4,11H,1H3

Composition: C (56.48%), H (4.15%), F (11.17%), O (28.21%)

Molar Mass: 170.139

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 170.037922248
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey GQWGNIURZTZLNL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.3
Topological Polar Surface Area 46.53
Polarizability 15.13
Ring Count 1
Rotatable Bond Count 2

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