AG006SHU

909709-42-8 | 4'-Propyl-3-fluoro-biphenyl-4-boronic acid

AG006SHU

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CAS Number	909709-42-8
Catalog Number	AG006SHU(AGN-PC-09RNO7)
Chemical Name	4'-Propyl-3-fluoro-biphenyl-4-boronic acid
IUPAC Name	[2-fluoro-4-(4-propylphenyl)phenyl]boronic acid
InChI	InChI=1S/C15H16BFO2/c1-2-3-11-4-6-12(7-5-11)13-8-9-14(16(18)19)15(17)10-13/h4-10,18-19H,2-3H2,1H3
InChI Key	XZGCBSYWWZAXRC-UHFFFAOYSA-N
MDL Number	MFCD10687198
Molecular Formula	C15H16BFO2
Molecular Weight	258.0957
SMILES	CCCC1=CC=C(C=C1)C1=CC(F)=C(C=C1)B(O)O
Synonyms	909709-42-8, (3-Fluoro-4'-propyl-[1,1'-biphenyl]-4-yl)boronic acid, 4'-PROPYL-3-FLUOROBIPHENYL-4-BORONIC ACID, 4''-PROPYL-3-FLUOROBIPHENYL-4-BORONIC ACID, 3-Fluoro-4'-propyl-4-biphenylboronic Acid, MFCD10687198, 3-Fluoro-4'-propyl-biphenylboronic acid, AK-81804, 4'-Propyl-3-fluoro-4-biphenyl boronic acid, 4'-Propyl-3-fluoro-biphenyl-4-boronic acid, (3-Fluoro-4'-propyl[1,1'-biphenyl]-4-yl)boronic acid, (3-Fluoro-4'-propyl[1,1'-biphenyl]-4-yl) boronic acid, Boronic acid, (3-fluoro-4'-propyl[1,1'-biphenyl]-4-yl)-, {3-fluoro-4'-propyl-[1,1'-biphenyl]-4-yl}boronic acid, KSC668M9T, C15H16BFO2, SCHEMBL1533780, CTK5G8699, KS-00000EXT, DTXSID90695025, XZGCBSYWWZAXRC-UHFFFAOYSA-N, 5172AC, ANW-58364, AKOS016003079, ZINC169744805, GS-6335, RL05715, XF10012, BC000719, PC412172, 3-Fluoro-4'-Propylbiphenyl-4-Boronic Acid, 4'-propyl-3-fluoro-4-biphenylboronic acid, AB0054544, AX8100104, DB-078848, RT-019892, 3-fluoro-4'-propylbiphenyl-4-ylboronic acid, 4CH-023825, F0942, FT-0731459, ST24034382, 4'-Propyl-3-fluoro-4-biphenyl boronic acid, 4-Propyl-3'-Fluorobiphenyl-4'-Boronic Acid, (3-fluoro-4'-propyl-4-biphenylyl)boronic acid, 2-fluoro-4-(4-propylphenyl)phenylboronic acid, 4-Propyl-3\'-Fluorobiphenyl-4\'-Boronic Acid, (3-Fluoro-4'-propylbiphenyl-4-yl)dihydroxyborane, 3-fluoro-4'-n-propylbiphenyl-4-boronic acid, 98%, J-515970, Boronicacid,B-(3-fluoro-4'-propyl[1,1'-biphenyl]-4-yl)-, B-(3-FLUORO-4'-PROPYL[1,1'-BIPHENYL]-4-YL)-BORONIC ACID, BORONIC ACID, B-(3-FLUORO-4'-PROPYL[1,1'-BIPHENYL]-4-YL)-, 4''-PROPYL-3-FLUOROBIPHENYL-4-BORONICACID, (3-Fluoro-4'-propyl-[1,1'-biphenyl]-4-yl)boronicacid, 2156-04-9,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	258.123g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	258.099g/mol
Monoisotopic Mass	258.123g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	40.5A^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

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