AG00341T

105365-50-2 | 4-Hexylphenylboronic Acid

AG00341T

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CAS Number	105365-50-2
Catalog Number	AG00341T(AGN-PC-0L71V8)
Chemical Name	4-Hexylphenylboronic Acid
IUPAC Name	(4-hexylphenyl)boronic acid
InChI	InChI=1S/C12H19BO2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10,14-15H,2-6H2,1H3
InChI Key	CFYBKGAFWFRFRJ-UHFFFAOYSA-N
MDL Number	MFCD04039029
Molecular Formula	C12H19BO2
Molecular Weight	206.0891
SMILES	C(CCCCC)C1=CC=C(C=C1)B(O)O
Synonyms	4-Hexylphenylboronic acid, 105365-50-2, (4-hexylphenyl)boronic Acid, 4-n-Hexylphenylboronic acid, 4-(Hex-1-yl)benzeneboronic acid, 4-N-HEXYLBENZENEBORONIC ACID, 1-Borono-4-(hex-1-yl)benzene, Boronic acid, (4-hexylphenyl)-, MFCD04039029, AK-84140, 4-HexylphenylboronicAcid, p-hexylphenylboronic acid, AC1N5NGK, 4-hexylbenzeneboronic acid, 4-hexylphenyl-boronic acid, ACMC-2098fs, 4-(n-hexyl)phenylboronic acid, SCHEMBL3136892, 1-Dihydroxyboryl-4-hexylbenzene, CTK8A9099, KS-00000ARU, DTXSID70400715, Boronic acid,b-(4-hexylphenyl)-, CFYBKGAFWFRFRJ-UHFFFAOYSA-N, ZX-AT004514, ANW-15206, CH-062, OR7224, AKOS004116074, ZINC169744814, AB17285, LS10915, RP04564, RTR-001113, TRA0065536, AS-18751, BC001957, SY024035, AB0029161, AX8167754, DB-059332, TR-001113, 4CH-001198, FT-0710437, ST24034709, X1301, A-4336, MFCD04039029 (97+%), I04-2266, J-515451, (4-n-Hexylphenyl)boronic acid, C12H19BO2, ACN-032654, CID4197864, H1489,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.148g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	206.092g/mol
Monoisotopic Mass	206.148g/mol
Rotatable Bond Count	6
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	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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