AG003BXS

120986-85-8 | 5-Bromopentylboronic acid

AG003BXS

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CAS Number	120986-85-8
Catalog Number	AG003BXS(AGN-PC-00114R)
Chemical Name	5-Bromopentylboronic acid
IUPAC Name	5-bromopentylboronic acid
InChI	InChI=1S/C5H12BBrO2/c7-5-3-1-2-4-6(8)9/h8-9H,1-5H2
InChI Key	RCBNHBWNONFWHR-UHFFFAOYSA-N
MDL Number	MFCD10000909
Molecular Formula	C5H12BBrO2
Molecular Weight	194.8626
SMILES	OB(O)CCCCCBr
Synonyms	(5-Bromopentyl)boronic acid, 5-BROMOPENTYLBORONIC ACID, 120986-85-8, C5H12BBrO2, ACMC-1BZ87, SCHEMBL170343, CTK4B2127, DTXSID80558817, Boronic acid,B-(5-bromopentyl)-, RCBNHBWNONFWHR-UHFFFAOYSA-N, 5-Bromopentylboronic acid, >=94%, ANW-17548, MFCD10000909, AKOS015836146, ZINC169904268, FCH1123129, RTR-003449, OR360449, AX8220431, TR-003449, Z8265, B-6633, I04-1832, J-004423,

Complexity	60.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.011g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.863g/mol
Monoisotopic Mass	194.011g/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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