AG003MQD

461451-63-8 | 5-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

AG003MQD

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	461451-63-8
Catalog Number	AG003MQD(AGN-PC-03LKIW)
Chemical Name	5-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
IUPAC Name	5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
InChI	InChI=1S/C13H15BFNO2/c1-12(2)13(3,4)18-14(17-12)11-6-5-10(15)7-9(11)8-16/h5-7H,1-4H3
InChI Key	IMEIHRCZDURBEC-UHFFFAOYSA-N
MDL Number	MFCD09260444
Molecular Formula	C13H15BFNO2
Molecular Weight	247.0731
SMILES	CC1(C)OB(OC1(C)C)C1=C(C=C(F)C=C1)C#N
Synonyms	461451-63-8, 2-CYANO-4-FLUOROPHENYLBORONIC ACID PINACOL ESTER, 5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile, MFCD09260444, 2-CYANO-4-FLUOROBENZENEBORONIC ACID PINACOL ESTER, 5-fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile, SCHEMBL2650777, CTK1D5040, DTXSID00623314, IMEIHRCZDURBEC-UHFFFAOYSA-N, KS-000010IA, ZX-AP000284, ANW-42924, PC7020, SBB100209, AKOS016005499, ZINC169747396, AB49977, CC-1666, FCH2717672, RTR-017377, ACM461451638, AK-85436, BBV-55272614, SY059455, AX8236260, ST2405058, TR-017377, CS-0089463, FT-0698433, MFCD09260444 (96%), B-3622, EN300-179765, A826994, (2-CYANO-4-FLUOROPHENYL)BORONIC ACID PINACOL ESTER, 5-Fluoro-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzonitrile, 5-fluoro-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)benzonitrile, 5-fluoranyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenecarbonitrile, 5-fluoro-2-(4,4,5,5-tetramethyl(1,3,2-dioxaborolan-2-yl))benzenecarbonitrile, ACN-034296, 3-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile, 624741-47-5,

Complexity	360
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.118g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	247.076g/mol
Monoisotopic Mass	247.118g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.2A^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

Lot Number