AG000QE8

120153-08-4 | Benzoic acid, 4-borono-2-fluoro-

AG000QE8

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CAS Number	120153-08-4
Catalog Number	AG000QE8(AGN-PC-0KKPD0)
Chemical Name	Benzoic acid, 4-borono-2-fluoro-
IUPAC Name	4-borono-2-fluorobenzoic acid
InChI	InChI=1S/C7H6BFO4/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,12-13H,(H,10,11)
InChI Key	CZDWJVSOQOMYGC-UHFFFAOYSA-N
MDL Number	MFCD01114671
Molecular Formula	C7H6BFO4
Molecular Weight	183.9295
SMILES	B(O)(O)c1cc(F)c(cc1)C(=O)O
Synonyms	4-carboxy-3-fluorophenylboronic acid, 4-Carboxy-3-fluorophenylboronic acid, 120153-08-4, 4-borono-2-fluorobenzoic acid, 4-carboxy-3-fluorobenzeneboronic acid, MFCD01114671, (4-carboxy-3-fluorophenyl)boronic acid, BENZOIC ACID, 4-BORONO-2-FLUORO-, AK143153, 4-(dihydroxyboranyl)-2-fluorobenzoic acid, PubChem5148, ACMC-209a6f, AC1MC7Y0, SCHEMBL362047, CTK4B1708, KS-00000LEV, DTXSID90376807, Benzoic acid,4-borono-2-fluoro-, CZDWJVSOQOMYGC-UHFFFAOYSA-N, BM447, ZXBA000364, ACT11030, ZX-AP000111, 3-fluoro-4-carboxyphenylboronic acid, ANW-17461, FCH920750, PC1644, SBB090106, 3-Fluoro-4-carboxy-phenylboronic acid, AKOS004119213, ZINC169743939, AB08322, CS-W000863, LS11010, PS-9412, RL00778, RP09026, RTC-068454, TRA0054531, VB10132, 2-Fluoro-4-(dihydroxyboryl)benzoic acid, AM803029, CC-18560, SC-19529, SY018035, AB0064601, AB1004744, DB-028787, TC-068454, TL8000536, 4CH-025079, FT-0642935, ST24043294, 4-(dihydroxyboranyl)-2-fluoranyl-benzoic acid, MFCD01114671 (98%), A-5396, F10163, 153C084, 4-Carboxy-3-fluorophenylboronic acid, AldrichCPR, A804548, C-07168, J-514869, 4-Carboxy-3-fluorophenylboronic acid; 4-Borono-2-fluorobenzoic acid, 5-borono-2-fluorobenzoic acid, cc-657, 3-Carboxy-4-fluorophenylboronicacid, 3-Carboxy-4-fluorophenylboronic acid, 4-fluoro-3-carboxyphenylboronic acid, ACN-032799, CID2763201, A2510, 120-66-1, 1206-46-8,

Complexity	199
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.034g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	183.929g/mol
Monoisotopic Mass	184.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number