3-Iodophthalic anhydride - CAS 28418-88-4

Catalog:	BB046758
Product Name:	3-Iodophthalic anhydride
CAS:	28418-88-4
Synonyms:	4-iodoisobenzofuran-1,3-dione; 4-iodo-1,3-Isobenzofurandione

Technical Data

Computed Properties

IUPAC Name:	4-iodo-2-benzofuran-1,3-dione
Description:	3-Iodophthalic anhydride (CAS# 28418-88-4 ) is a useful research chemical.
Molecular Weight:	274.01
Molecular Formula:	C8H3IO3
Canonical SMILES:	C1=CC2=C(C(=C1)I)C(=O)OC2=O
InChI:	InChI=1S/C8H3IO3/c9-5-3-1-2-4-6(5)8(11)12-7(4)10/h1-3H
InChI Key:	SKHCDRLTAOLKHQ-UHFFFAOYSA-N
Boiling Point:	377.9±25.0 °C (Predicted)
Melting Point:	159-161 °C
Purity:	≥ 97 %
Density:	2.198±0.06 g/cm³ (Predicted)

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Related Functional Groups

Benzofuran/Benzothiophene

[76981-71-0]
Ethyl 2-amino-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
[1934854-71-3]
N-Boc-7-aminobenzofuran
[2649788-75-8]
tert-butyl N-(4-bromo-3-cyano-benzothiophen-2-yl)carbamate
[33975-30-3]
4-(Nonyloxycarbonyl)-1,2-benzenedicarboxylic anhydride
[351980-88-6]
Methyl 2-amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
[148961-81-3]
2-Tributylstannylbenzo[b]furan

Carbonyl Compounds

[87-88-7]
Chloranilic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

Halides

[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[444581-46-8]
1-Bromo-2-(1,1-difluoroethyl)benzene
[1936054-65-7]
2,4-Dichloro-3,6-dimethylquinoline

Complexity:	239
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	273.91269
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	273.91269
Rotatable Bond Count:	0
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9