AG001SOA

162045-31-0 | 1-(piperidin-4-yl)-1H-benzo[d][1,3]oxazin-2(4H)-one hydrochloride

AG001SOA

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CAS Number	162045-31-0
Catalog Number	AG001SOA(AGN-PC-03JULK)
Chemical Name	1-(piperidin-4-yl)-1H-benzo[d][1,3]oxazin-2(4H)-one hydrochloride
IUPAC Name	1-piperidin-4-yl-4H-3,1-benzoxazin-2-one;hydrochloride
InChI	InChI=1S/C13H16N2O2.ClH/c16-13-15(11-5-7-14-8-6-11)12-4-2-1-3-10(12)9-17-13;/h1-4,11,14H,5-9H2;1H
InChI Key	KLZHMTYGKHMRBO-UHFFFAOYSA-N
MDL Number	MFCD09999158
Molecular Formula	C13H17ClN2O2
Molecular Weight	268.7393
SMILES	Cl.O=C1(OCC3(=CC=CC=C3(N1C2(CCNCC2))))
Synonyms	162045-31-0, 1-(4-Piperidinyl)-1,2-dihydro-4H-3,1-benzoxazin-2-one hydrochloride, 1-(piperidin-4-yl)-1H-benzo[d][1,3]oxazin-2(4H)-one hydrochloride, J-503602, SCHEMBL2267895, CTK8B7052, DTXSID60622202, KLZHMTYGKHMRBO-UHFFFAOYSA-N, KS-00002B2R, 8199AA, ANW-56290, CP-929, MFCD09999158, AKOS005073897, piperidinylbenzodoxazinHonehydrochloride, H45P310, MCULE-6658375785, RP15065, SS-3874, AK-24446, AB0072778, AX8159248, DB-064432, TR-006923, 4CH-004415, FT-0681848, I14-8561, 1-piperidin-4-yl-4H-3,1-benzoxazin-2-one hydrochloride, 1-(piperidin-4-yl)-4H-3,1-benzoxazin-2-one hydrochloride, 1-(4-piperidinyl)-4H-3,1-benzoxazin-2(1H)-one hydrochloride, 1-(4-piperidinyl)-1,4-dihydro-2h-3,1-benzoxazinone hydrochloride, 1-(PIPERIDIN-4-YL)-1H-BENZO[D][1,3]OXAZIN-2(4H)-ONE HCL, 1-piperidin-4yl-1,4-dihydro-2h-3,1-benzoxazin-2-one hydrochloride, 1,4-dihydro-1-(4-piperidinyl)-2H-3,1-Benzoxazin-2-one hydrochloride, 1-piperidin-4-yl-1,4-dihydro-2H-3,1-benzoxazin-2-one hydrochloride, 1-Piperidin-4-yl-1,4-dihydro-benzo[d][1,3]oxazin-2-one hydrochloride, 1-(Piperidin-4-yl)-1,4-dihydro-2H-3,1-benzoxazin-2-one--hydrogen chloride (1/1), C13H17ClN2O2, ACN-032309, 1-(piperidin-4-yl)-1h-benzo[d][1,3]oxazin-2(4h)-one, 1-(4-Piperidinyl)-1,2-dihydro-4H-3,1-benzoxazin-2-onehydrochloride,

Complexity	289
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.098g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	268.741g/mol
Monoisotopic Mass	268.098g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.6A^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	P280-P305+P351+P338
UN Code

Certificate of Analysis

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