AG003LXC

121219-12-3 | (4-Pentylphenyl)boronic acid

AG003LXC

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CAS Number	121219-12-3
Catalog Number	AG003LXC(AGN-PC-0LDRJ7)
Chemical Name	(4-Pentylphenyl)boronic acid
IUPAC Name	(4-pentylphenyl)boronic acid
InChI	InChI=1S/C11H17BO2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h6-9,13-14H,2-5H2,1H3
InChI Key	UZRMPSOGFATLJE-UHFFFAOYSA-N
MDL Number	MFCD00995151
Molecular Formula	C11H17BO2
Molecular Weight	192.0625
SMILES	C(CCCC)c1ccc(cc1)B(O)O
Synonyms	121219-12-3, (4-pentylphenyl)boronic Acid, 4-n-Pentylphenylboronic acid, 4-Pentylbenzeneboronic acid, 4-Pentylphenylboronic Acid, 4-N-PENTYLBENZENEBORONIC ACID, 4-Pentylbenzene boronic acid, 4-Amylphenylboronic Acid, MFCD00995151, CHEMBL1952296, Boronic acid, (4-pentylphenyl)-, 4-Amylbenzeneboronic Acid, AC1NEANY, PubChem16788, 4-Pentylphenylboronicacid, AC1Q2VQA, ACMC-1C8SW, P-pentylbenzeneboronic acid, KSC173S0P, 4-n-pentylphenyl boronic acid, AKOS BRN-0130, 4-n-pentylbenzene boronic acid, SCHEMBL1509988, CTK0H3907, KS-00000AQV, DTXSID50404610, UZRMPSOGFATLJE-UHFFFAOYSA-N, 4-N-AMYLBENZENEBORONIC ACID, ACN-S004009, BCP22757, ANW-17579, BDBM50364283, AKOS004116473, ZINC169744833, AB07922, BCP9000264, CS-W002722, GS-6717, LS10094, MCULE-5329174072, RP07424, RTR-003474, TRA0050297, 4-N-Pentylphenylboronic acid, AldrichCPR, AC-24820, AK-32994, BC000714, BR-32994, N272, SC-22963, SY015715, AB0015668, AB1004693, DB-028990, ST2408042, TL8000563, TR-003474, AM20050555, FT-0084922, FT-0619317, A-5425, MFCD00995151 (97+%), 219P123, A804694, I01-1733, J-515894, 4-n-Amylbenzeneboronic acid; 4-n-Pentylphenylboronic acid, C11H17BO2, Boronic acid, B-(4-pentylphenyl)-, ACN-032667, CID4589191, 4-Pentylbenzeneboronic acid, 95% - 1G 1g, A2336,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.132g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	192.065g/mol
Monoisotopic Mass	192.132g/mol
Rotatable Bond Count	5
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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