AG000V9L

1309982-57-7 | 2-Ethoxy-3-fluoropyridine-5-boronic acid

AG000V9L

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CAS Number	1309982-57-7
Catalog Number	AG000V9L(AGN-PC-0WAML7)
Chemical Name	2-Ethoxy-3-fluoropyridine-5-boronic acid
IUPAC Name	(6-ethoxy-5-fluoropyridin-3-yl)boronic acid
InChI	InChI=1S/C7H9BFNO3/c1-2-13-7-6(9)3-5(4-10-7)8(11)12/h3-4,11-12H,2H2,1H3
InChI Key	SMQWQXHLVIJJQY-UHFFFAOYSA-N
MDL Number	MFCD07374965
Molecular Formula	C7H9BFNO3
Molecular Weight	184.9607
SMILES	FC1=C(OCC)N=CC(B(O)O)=C1
Synonyms	(6-Ethoxy-5-fluoropyridin-3-yl)boronic acid, 1309982-57-7, AK-37064, 6-ethoxy-5-fluoropyridine-3-boronic acid, Boronic acid, B-(6-ethoxy-5-fluoro-3-pyridinyl)-, SCHEMBL14659133, CTK8C4974, KS-00000JTA, DTXSID30672092, 5661AA, ANW-73649, FCH855941, MFCD07374965, AKOS006287050, ZINC169916892, AB40832, 6-Ethoxy-5-fluoropyridine3-boronic acid, AS-49921, (6-ethoxy-5-fluoro-3-pyridyl)boronic acid, AX8023864, TC-162394, FT-0751545, (6-ethoxy-5-fluoro-3-pyridinyl)boronic acid, (6-ethoxy-5-fluoranyl-pyridin-3-yl)boronic acid, 2-ETHOXY-3-FLUOROPYRIDINE-5-BORONIC ACID, C7H9BFNO3, (6-Ethoxy-5-fluoropyridin-3-yl)boronicacid,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.066g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	184.961g/mol
Monoisotopic Mass	185.066g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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