4-hydroxy-3-iodo-5-methoxybenzaldehyde

4-hydroxy-3-iodo-5-methoxybenzaldehyde

CAS: 5438-36-8

Formula: C8H7IO3

SMILES: COC1=CC(C=O)=CC(I)=C1O

IUPAC: 4-hydroxy-3-iodo-5-methoxybenzaldehyde

InChI: InChI=1S/C8H7IO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3

Composition: C (34.56%), H (2.54%), I (45.64%), O (17.26%)

Molar Mass: 278.045

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	277.94399
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	FBBCSYADXYILEH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.45
Topological Polar Surface Area	46.53
Polarizability	20.7
Ring Count	1
Rotatable Bond Count	2

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