AG002ZZT

304-91-6 | Benzoic acid, 2-iodosyl-

AG002ZZT

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CAS Number	304-91-6
Catalog Number	AG002ZZT(AGN-PC-0WANR1)
Chemical Name	Benzoic acid, 2-iodosyl-
EC Number	206-159-4
IUPAC Name	2-iodosylbenzoic acid
InChI	InChI=1S/C7H5IO3/c9-7(10)5-3-1-2-4-6(5)8-11/h1-4H,(H,9,10)
InChI Key	IFPHDUVGLXEIOQ-UHFFFAOYSA-N
MDL Number	MFCD00002401
Molecular Formula	C7H5IO3
Molecular Weight	264.0173
NSC Number	34548
SMILES	I(=O)C1=C(C(=O)O)C=CC=C1
Synonyms	2-iodosobenzoate, 2-iodosobenzoic acid, ortho-iodosobenzoate, ortho-iodosobenzoic acid, 2-Iodosobenzoic acid, 2-Iodosylbenzoic acid, 304-91-6, o-Iodosobenzoic acid, o-Iodosylbenzoic acid, o-Iodosobenzoate, Benzoic acid, 2-iodosyl-, Benzoic acid, o-iodoso-, 2-Iodosyl benzoate, Benzoic acid, iodosyl-, NSC 34548, ortho-iodosylbenzoic acid, EINECS 206-159-4, 3H-1,2-Benziodoxol-1-ium, 3-oxo-, hydroxide, BRN 1939973, IFPHDUVGLXEIOQ-UHFFFAOYSA-N, Benzoic acid, 2-iodosyl- (9CI)-, GEO-02801, MFCD00002401, 27323-35-9, 2-iodosobenzoate, 2-Iodosobenzoic acid, 98%, Iodosobenzoate, Iodosobenzoic acid, Benzoic acid, iodoso- (8CI), Iodosylbenzoic acid, ortho-iodosobenzoate, Iodosyl benzoic acid, NSC 106636, ortho-iodosobenzoic acid, ACMC-209hgh, AC1L27RN, 3-09-00-01433 (Beilstein Handbook Reference), 2-IODOSO BENZOIC ACID, 3H-1, 3-oxo-, hydroxide, SCHEMBL301837, BIM111, Benzoic acid, iodosyl- (9CI), DTXSID8075382, CHEBI:52698, CTK1A3261, ZX-AFC003046, ACT05089, ALBB-030082, NSC34548, ZX-AN080889, ZX-AT019484, 7834AF, ACM304916, ANW-26895, CI-533, NSC-34548, OR7133, AKOS015891293, FCH1319920, MCULE-9514632532, RTR-013102, AN-44202, CC-11070, LS-37732, TR-013102, FT-0698200, I0073, ST51006755, 304I916, C-33471, I01-8878, J-017990, InChI=1/C7H5IO3/c9-7(10)5-3-1-2-4-6(5)8-11/h1-4H,(H,9,10, Benzoic acid, iodoso-, C7H5IO3, C7-H5-I-O3, CID67537, 2-Iodosobenzoic acid, 95% - 1G 1g, 1-Hydroxy-1,2-benziodoxol-3(1H)-one, IBA,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.928g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	264.018g/mol
Monoisotopic Mass	263.928g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Siginal words

Certificate of Analysis

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