AG0070JS

215878-20-9 | 3-(4-Piperidinyl)-1,3-benzoxazol-2(3H)-one

AG0070JS

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CAS Number	215878-20-9
Catalog Number	AG0070JS(AGN-PC-006R9X)
Chemical Name	3-(4-Piperidinyl)-1,3-benzoxazol-2(3H)-one
IUPAC Name	3-piperidin-4-yl-1,3-benzoxazol-2-one
InChI	InChI=1S/C12H14N2O2/c15-12-14(9-5-7-13-8-6-9)10-3-1-2-4-11(10)16-12/h1-4,9,13H,5-8H2
InChI Key	SDARRYSVKYQEIW-UHFFFAOYSA-N
MDL Number	MFCD09999150
Molecular Formula	C12H14N2O2
Molecular Weight	218.2518
SMILES	N1CCC(CC1)N2C3=C(OC2=O)C=CC=C3
Synonyms	3-(4-Piperidinyl)-1,3-benzoxazol-2(3H)-one, 215878-20-9, 3-(piperidin-4-yl)benzo[d]oxazol-2(3H)-one, AK-24430, 3-(piperidin-4-yl)-2,3-dihydro-1,3-benzoxazol-2-one, SCHEMBL830500, CTK0J9603, DTXSID90462299, SDARRYSVKYQEIW-UHFFFAOYSA-N, KS-00000HF7, ANW-51589, MFCD09999150, ZINC40448338, AKOS015854449, 3-(4-piperidinyl)benzoxazolidin-2-one, FS-2767, 4-(2-oxo-3-benzoxazolinyl)-piperidine, ACM215878209, BR-24430, 2(3H)-Benzoxazolone, 3-(4-piperidinyl)-, AB0023430, AJ-102648, AX8158423, TR-010138, 3-(piperidin-4-yl)-1,3-benzoxazol-2-one, 4CH-007992, FT-0646013, ST24028312, W4481, S-6217, C12H14N2O2, 3-(4-piperidyl)benzooxazol-2-one, 3-piperidin-4-yl-3h-benzooxazol-2-one, CID11321928,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.106g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	218.256g/mol
Monoisotopic Mass	218.106g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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