3-Hydroxy-4-iodobenzoic acid - CAS 58123-77-6

Name: 3-Hydroxy-4-iodobenzoic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB029941
Product Name:	3-Hydroxy-4-iodobenzoic acid
CAS:	58123-77-6
Synonyms:	3-hydroxy-4-iodobenzoic acid

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Computed Properties

IUPAC Name:	3-hydroxy-4-iodobenzoic acid
Description:	3-Hydroxy-4-iodobenzoic acid (CAS# 58123-77-6) is a useful research chemical.
Molecular Weight:	264.02
Molecular Formula:	C7H5IO3
Canonical SMILES:	C1=CC(=C(C=C1C(=O)O)O)I
InChI:	InChI=1S/C7H5IO3/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,9H,(H,10,11)
InChI Key:	UABBBWVTEWIIMN-UHFFFAOYSA-N
Boiling Point:	319.8 °C at 760 mmHg
Melting Point:	227-229 °C
Purity:	98 %
Density:	2.155 g/cm³
MDL:	MFCD02068386
LogP:	1.69500

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

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GHS Hazard Statement:	H301 (86.96%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

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Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	263.92834
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	263.92834
Rotatable Bond Count:	1
Topological Polar Surface Area:	57.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7