AG001R15

158937-25-8 | Boronic acid, B-[4'-(pentyloxy)[1,1'-biphenyl]-4-yl]-

AG001R15

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CAS Number	158937-25-8
Catalog Number	AG001R15(AGN-PC-007HTT)
Chemical Name	Boronic acid, B-[4'-(pentyloxy)[1,1'-biphenyl]-4-yl]-
IUPAC Name	[4-(4-pentoxyphenyl)phenyl]boronic acid
InChI	InChI=1S/C17H21BO3/c1-2-3-4-13-21-17-11-7-15(8-12-17)14-5-9-16(10-6-14)18(19)20/h5-12,19-20H,2-4,13H2,1H3
InChI Key	DBDYXLZXTNHAFI-UHFFFAOYSA-N
MDL Number	MFCD07644475
Molecular Formula	C17H21BO3
Molecular Weight	284.1578
SMILES	C(CCCC)OC1=CC=C(C=C1)C1=CC=C(C=C1)B(O)O
Synonyms	158937-25-8, (4'-(Pentyloxy)-[1,1'-biphenyl]-4-yl)boronic acid, [4'-(pentyloxy)[1,1'-biphenyl]-4-yl]boronic acid, [4'-(Pentyloxy)[1,1'-biphenyl]-4-yl] boronic acid, Boronic acid, [4'-(pentyloxy)[1,1'-biphenyl]-4-yl]-, AK-87574, 4-(4-n-pentyloxyphenyl)phenylboronic acid, J-502759, 4 inverted exclamation mark -(Pentyloxy)biphenyl-4-boronic acid, [4'-(Pentyloxy)-[1,1'-biphenyl]-4-yl]boronic Acid, SCHEMBL2555796, CTK0B0250, KS-00000ZFK, DTXSID70463507, DBDYXLZXTNHAFI-UHFFFAOYSA-N, 4'-Amyloxybiphenyl-4-boronic Acid, 4'-n-pentoxybiphenyl-4-boronic acid, 7980AA, ANW-67601, MFCD07644475, AKOS016006475, ZINC169747410, 4'-N-pentyloxybiphenyl-4-boronic acid, CS-W004379, RL02042, 4-(4-n-pentoxyphenyl)phenylboronic acid, 4-(4-Pentyloxyphenyl)benzeneboronic acid, 4-(4-n-pentoxyphenyl)phenyl-boronic acid, BC000813, DS-18345, OR360568, SY043374, AX8236957, DB-064250, ST2402362, TC-156346, 4CH-017727, FT-0736299, P2365, MFCD07644475 (95%), [4'-(pentyloxy)[1,1'-biphenyl]-4-yl]boronicacid, (4\'-(Pentyloxy)-[1,1\'-biphenyl]-4-yl)boronic acid, Boronic acid, B-[4'-(pentyloxy)[1,1'-biphenyl]-4-yl]-, 4'-Pentyloxybiphenyl-4-boronic Acid (contains varying amounts of Anhydride), 4'-n-Pentyloxybiphenyl-4-boronic acid (contains varying amounts of anhydride), C17H21BO3, ACN-036137, CID11358071, [4-(4-pentoxyphenyl)phenyl]boronic Acid, [4/'-(Pentyloxy)[1,1/'-biphenyl]-4-yl]boronic acid,

Complexity	269
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	284.158g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	284.162g/mol
Monoisotopic Mass	284.158g/mol
Rotatable Bond Count	7
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
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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