AG006BM2

913835-30-0 | 2-CHLORO-5-ETHOXYBENZENEBORONIC ACID 97

AG006BM2

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CAS Number	913835-30-0
Catalog Number	AG006BM2(AGN-PC-03NS0P)
Chemical Name	2-CHLORO-5-ETHOXYBENZENEBORONIC ACID 97
IUPAC Name	(2-chloro-5-ethoxyphenyl)boronic acid
InChI	InChI=1S/C8H10BClO3/c1-2-13-6-3-4-8(10)7(5-6)9(11)12/h3-5,11-12H,2H2,1H3
InChI Key	LIFPTULDIUUUBK-UHFFFAOYSA-N
MDL Number	MFCD08235081
Molecular Formula	C8H10BClO3
Molecular Weight	200.4272
SMILES	CCOC1=CC=C(Cl)C(B(O)O)=C1
Synonyms	(2-Chloro-5-ethoxyphenyl)boronic acid, 913835-30-0, 2-Chloro-5-ethoxyphenylboronic acid, 2-Chloro-5-ethoxybenzeneboronic acid, SCHEMBL544415, 3'-Borono-4'-chlorophenetole, ACMC-209r91, CTK3I6355, DTXSID50624593, LIFPTULDIUUUBK-UHFFFAOYSA-N, 1-Borono-2-chloro-5-ethoxybenzene, ZX-AT009038, ANW-39587, MFCD08235081, OR9463, AKOS015849885, ZINC169745157, FCH1323695, RTR-028624, B-(2-Chloro-5-ethoxy-phenyl)boronic acid, AX8231329, Boronic acid,b-(2-chloro-5-ethoxyphenyl)-, TR-028624, FT-0688873, ST24020198, V8992, Boronic acid, B-(2-chloro-5-ethoxyphenyl)-, B-4257, 2-Chloro-5-ethoxyphenylboronic acid, AldrichCPR, I04-2501, J-519641, C8H10BClO3, (2-Chloro-5-ethoxyphenyl)boronicacid, 2-CHLORO-5-ETHOXYBENZENEBORONICACID97,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.041g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	200.425g/mol
Monoisotopic Mass	200.041g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code	\N

Certificate of Analysis

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