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ethyl 4-hydroxy-3-iodobenzoate

ethyl 4-hydroxy-3-iodobenzoate

CAS: 15126-07-5

Formula: C9H9IO3

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

IUPAC: ethyl 4-hydroxy-3-iodobenzoate

InChI: InChI=1S/C9H9IO3/c1-2-13-9(12)6-3-4-8(11)7(10)5-6/h3-5,11H,2H2,1H3

Composition: C (37.01%), H (3.11%), I (43.45%), O (16.43%)

Molar Mass: 292.072

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 291.95964
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HOAXKZYYZXASLJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.18
Topological Polar Surface Area 46.53
Polarizability 22.5
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 15126-07-5 $230.81-$548.55$230.81$310.50$548.55
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 15126-07-5 $166.75-$423.20$166.75$231.15$423.20
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Chemcia Scientific, LLC
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 15126-07-5 $195.50-$1,144.25$195.50$684.25$1,144.25
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