AG00340D

452972-15-5 | 4-Chloropyridine-3-boronic acid, pinacol ester

AG00340D

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CAS Number	452972-15-5
Catalog Number	AG00340D(AGN-PC-0NHOB2)
Chemical Name	4-Chloropyridine-3-boronic acid, pinacol ester
IUPAC Name	4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI	InChI=1S/C11H15BClNO2/c1-10(2)11(3,4)16-12(15-10)8-7-14-6-5-9(8)13/h5-7H,1-4H3
InChI Key	KTLJNRVZMVZXMR-UHFFFAOYSA-N
MDL Number	MFCD06798247
Molecular Formula	C11H15BClNO2
Molecular Weight	239.5063
SMILES	ClC1=C(C=NC=C1)B1OC(C(O1)(C)C)(C)C
Synonyms	452972-15-5, 4-Chloropyridine-3-boronic acid pinacol ester, 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, 4-Chloropyridine-3-boronic acid, pinacol ester, 4-Chloropyridin-3-ylboronic acid, pinacol ester, 4-chloro-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, Pyridine, 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, SCHEMBL166233, CTK8B3148, KS-00000ATS, DTXSID00476867, KTLJNRVZMVZXMR-UHFFFAOYSA-N, ABBYPHARMA AP-12-5237, ZX-AT022185, ANW-41845, BBL103164, MFCD06798247, OR3315, STL556974, AKOS015949908, ZINC169745952, AB29854, CC-2082, FCH2716530, GS-6280, RTR-017247, TRA-0184099, ACM452972155, AK-40525, AN-28253, BC002050, SC-32024, SY023186, 4-Chloropyridine-3-boronicAcidPinacolEster, AB0029221, AX8162154, TR-017247, AM20051194, CS-0054405, FT-0678866, ST24043573, X1361, MFCD06798247 (98%), A25344, A25354, Z-2594, 972C155, J-515192, 4-CHLORO-3-PYRIDINEBORONIC ACID PINACOL ESTER, (4-CHLOROPYRIDIN-3-YL)BORONIC ACID PINACOL ESTER, 4-chloranyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, 4-chloro-3-(4,4,5,5-tetramethyl-[1,3,2]dioxa borolan-2-yl)-pyridine, 4-chloro-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridine, C11H15BClNO2,

Complexity	257
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.088g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	239.506g/mol
Monoisotopic Mass	239.088g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	31.4A^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-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number