AG000FMF

1150114-62-7 | 2-(Ethoxycarbonyl)furan-3-boronic acid

AG000FMF

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CAS Number	1150114-62-7
Catalog Number	AG000FMF(AGN-PC-07XUDB)
Chemical Name	2-(Ethoxycarbonyl)furan-3-boronic acid
IUPAC Name	(2-ethoxycarbonylfuran-3-yl)boronic acid
InChI	InChI=1S/C7H9BO5/c1-2-12-7(9)6-5(8(10)11)3-4-13-6/h3-4,10-11H,2H2,1H3
InChI Key	HKNNWKBXXSBMED-UHFFFAOYSA-N
MDL Number	MFCD12025973
Molecular Formula	C7H9BO5
Molecular Weight	183.9544
SMILES	O=C(C1=C(B(O)O)C=CO1)OCC
Synonyms	1150114-62-7, (2-(Ethoxycarbonyl)furan-3-yl)boronic acid, 2-(Ethoxycarbonyl)furan-3-boronic acid, TP-4748, AK-93082, [2-(Ethoxycarbonyl)furan-3-yl]boronic acid, ACMC-2099mz, CTK4A9044, DTXSID40675074, BCP20829, KS-00000Q0J, ANW-16761, MFCD12025973, AKOS006315556, ZINC169746487, ACN-052483, RTR-002760, (2-ethoxycarbonylfuran-3-yl)boronic acid, DS-17775, OR360402, AX8230792, TR-002760, ST24020164, Z7550, A-5069, 2-Furancarboxylic acid, 3-borono-, 2-ethyl ester, I04-2105, C7H9BO5,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.054g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	183.954g/mol
Monoisotopic Mass	184.054g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	79.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number