AG001Q3P

1583-67-1 | 1,2-Benzenedicarboxylic acid, 3-fluoro-

AG001Q3P

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CAS Number	1583-67-1
Catalog Number	AG001Q3P(AGN-PC-0JMGT7)
Chemical Name	1,2-Benzenedicarboxylic acid, 3-fluoro-
EC Number	216-433-5
IUPAC Name	3-fluorophthalic acid
InChI	InChI=1S/C8H5FO4/c9-5-3-1-2-4(7(10)11)6(5)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI Key	BBCQSMSCEJBIRD-UHFFFAOYSA-N
MDL Number	MFCD00039524
Molecular Formula	C8H5FO4
Molecular Weight	184.1213
NSC Number	402999
SMILES	FC1=C(C(C(=O)O)=CC=C1)C(=O)O
Synonyms	3-Fluorophthalic acid, 1583-67-1, 3-fluorobenzene-1,2-dicarboxylic acid, 3-Fluoro-1,2-benzenedicarboxylic acid, 1,2-Benzenedicarboxylic acid, 3-fluoro-, BBCQSMSCEJBIRD-UHFFFAOYSA-N, MFCD00039524, 1,2-Benzenedicarboxylic acid, fluoro-, 3-fluorophthalate, AK-41838, 1583-67-1 3-Fluorophthalic acid, 3-fluorophthalic, 3-fluorophtalic acid, NSC402999, 3-Fluorophthatic acid, PubChem1405, 3-fluorophthalicacid98%, Intermediates-ZCF02198, AC1L82ND, 3-fluorophthalic acid 98%, ACMC-1BO13, KSC178I1N, 3-Fluorophthalic acid, 98%, SCHEMBL335939, CHEMBL1161937, BBCQSMSCEJBIRD-UHFFFAOYSA-, CTK0H8416, KS-00000FFH, PC4179L, 3-fluorophthalic acid, 98% 5gr, WT491, ZINC156106, ACT08715, ZX-AP002833, ANW-21756, BBL100274, CF-958, SBB063893, STL553839, TD1019, WT2204, AKOS005206827, AC-9811, AS00856, CM13824, CS-W007402, FCH1115654, LS10518, MCULE-7732883800, NSC-402999, PS-6605, RTR-035828, TF10669, VZ26898, 1,2-Benzenedicarboxylicacid, 3-fluoro-, AJ-13700, AN-49494, CC-15189, Q554, SC-46468, AB0017661, AX8010909, TR-035828, 4CH-006870, F0353, FT-0081861, FT-0612058, ST24028533, ST50825210, C-07187, I01-3228, InChI=1/C8H5FO4/c9-5-3-1-2-4(7(10)11)6(5)8(12)13/h1-3H,(H,10,11)(H,12,13), 2,2-Difluorobenzodioxole, C8H5FO4, C8-H5-F-O4, ACN-S005532, EINECS 216-433-5, 2,2-difluoro-2H-1,3-benzodioxole, CID345381, NSC 402999, 3-Fluorophthalic acid, 97% - 1G 1g,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.017g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	184.122g/mol
Monoisotopic Mass	184.017g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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