AG005YDL

957065-85-9 | 2-Ethoxy-5-methoxyphenylboronic acid

AG005YDL

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CAS Number	957065-85-9
Catalog Number	AG005YDL(AGN-PC-0713DR)
Chemical Name	2-Ethoxy-5-methoxyphenylboronic acid
IUPAC Name	(2-ethoxy-5-methoxyphenyl)boronic acid
InChI	InChI=1S/C9H13BO4/c1-3-14-9-5-4-7(13-2)6-8(9)10(11)12/h4-6,11-12H,3H2,1-2H3
InChI Key	QZURUWKQPQTXPR-UHFFFAOYSA-N
MDL Number	MFCD09878346
Molecular Formula	C9H13BO4
Molecular Weight	196.0081
SMILES	OB(C1=CC(OC)=CC=C1OCC)O
Synonyms	2-ETHOXY-5-METHOXYPHENYLBORONIC ACID, 957065-85-9, 2-Ethoxy-5-methoxybenzeneboronic acid, (2-ethoxy-5-methoxyphenyl)boronic acid, (2-ethoxy-5-methoxy-phenyl)boronic acid, AK-40474, ACMC-209s36, SCHEMBL15862688, CTK3I6502, KS-00000HWH, DTXSID50657306, 2-Ethoxy-5-methoxyphenylboronicacid, ZX-AT012865, ANW-40672, CE-258, MFCD09878346, SBB071206, AKOS006343983, ZINC169747973, OR59337, RL06044, RTR-029971, VB10249, AN-26085, BBV-38359787, BC001285, DS-13570, AX8161611, DB-010410, TR-029971, FT-0659924, ST24040525, V9759, B-5687, 065E859, A845419, I04-0685, J-509294, C9H13BO4, 2-Ethoxy-5-methoxybenzeneboronicacid,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.091g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	196.009g/mol
Monoisotopic Mass	196.091g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	58.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

Lot Number