AG003MRE

84163-16-6 | 5-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole hydrochloride

AG003MRE

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CAS Number	84163-16-6
Catalog Number	AG003MRE(AGN-PC-0KL734)
Chemical Name	5-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole hydrochloride
IUPAC Name	5-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride
InChI	InChI=1S/C12H13FN2O.ClH/c13-9-1-2-11-10(7-9)12(15-16-11)8-3-5-14-6-4-8;/h1-2,7-8,14H,3-6H2;1H
InChI Key	HSOJFILHZZEWJT-UHFFFAOYSA-N
MDL Number	MFCD06200879
Molecular Formula	C12H14ClFN2O
Molecular Weight	256.7038
SMILES	FC1=CC=C(ON=C2C3CCNCC3)C2=C1.[H]Cl
Synonyms	84163-16-6, 5-fluoro-3-(piperidin-4-yl)benzo[d]isoxazole hydrochloride, 5-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole hydrochloride, 5-Fluoro-3-piperidin-4-yl-1,2-benzisoxazole hydrochloride, 5-fluoro-3-(piperidin-4-yl)-1,2-benzoxazole hydrochloride, MFCD06200879, 4-(5-Fluoro-1,2-benzisoxazol-3-yl)piperidine hydrochloride, 1,2-Benzisoxazole,5-fluoro-3-(4-piperidinyl)-, hydrochloride, F9995-0329, HSOJFILHZZEWJT-UHFFFAOYSA-N, AC1MDRTK, PubChem11469, 5-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole HCl, SCHEMBL8916694, CTK7C1423, DTXSID00383380, BCP15038, BCP21060, 0373AF, SBB056181, AKOS005146268, MCULE-2379722287, PS-7398, TRA0008556, AC-27286, AB0071935, DB-004999, FT-0668729, VU0549340-1, A840727, 5-fluoro-3-(piperidin-4-yl)benzisoxazole HCl salt, 5-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole, HCl, 5-fluoro-3-(4-piperidyl)benzo[d]isoxazole, chloride, 5-fluoro-3-piperidin-4-yl-1,2-benzoxazole hydrochloride, 5-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride, 5-fluoranyl-3-piperidin-4-yl-1,2-benzoxazole hydrochloride, 5-fluoro-3-(4-piperidinyl)-1,2-benzoxazole hydrochloride, 5-Fluoro-3-(4-piperidyl)-1,2-benzisoxazole hydrochloride, 1,2-Benzisoxazole, 5-fluoro-3-(4-piperidinyl)-, monohydrochloride, 5-Fluoro-3-(piperidin-4-yl)-1,2-benzoxazole--hydrogen chloride (1/1), 5-Fluoro amb, 5F-AMB, C12H14ClFN2O, CID2794754, 5-fluoro-3-(4-piperidyl)benzo[d]isoxazole Hydrochloride, 84163-64-4,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.078g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	256.705g/mol
Monoisotopic Mass	256.078g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.1A^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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