AG001D72

14558-49-7 | 2H-1,3-Oxazine, tetrahydro-

AG001D72

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CAS Number	14558-49-7
Catalog Number	AG001D72(AGN-PC-0JP9F8)
Chemical Name	2H-1,3-Oxazine, tetrahydro-
IUPAC Name	1,3-oxazinane
InChI	InChI=1S/C4H9NO/c1-2-5-4-6-3-1/h5H,1-4H2
InChI Key	LQPOOAJESJYDLS-UHFFFAOYSA-N
MDL Number	MFCD13191587
Molecular Formula	C4H9NO
Molecular Weight	87.1204
NSC Number	147293
SMILES	O1CNCCC1
Synonyms	1,3-oxazinane, 14558-49-7, 2H-1,3-Oxazine, tetrahydro-, tetrahydro-2H-1,3-Oxazine, NSC147293, tetrahydro-1,3-oxazine, AC1Q70BW, 2H-1,3-Oxazine,tetrahydro-, AC1L677G, CTK4C4612, DTXSID80301901, LQPOOAJESJYDLS-UHFFFAOYSA-N, KS-00000IN1, ZINC1729089, MFCD13191587, AKOS006352481, CS-W007123, NSC-147293, AJ-31174, AK-82623, DB-063615, TX-015845, FT-0708366, ST24036821, I14-17357, InChI=1/C4H9NO/c1-2-5-4-6-3-1/h5H,1-4H, 2H-1, tetrahydro-, KST-1B0519, AR-1B7233, CID287364, 14618-77-0,

Complexity	38.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	87.068g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	87.122g/mol
Monoisotopic Mass	87.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	21.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number