AG003DLC

5259-97-2 | 1,3-Oxazinan-2-one

AG003DLC

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CAS Number	5259-97-2
Catalog Number	AG003DLC(AGN-PC-0JU7SO)
Chemical Name	1,3-Oxazinan-2-one
IUPAC Name	1,3-oxazinan-2-one
InChI	InChI=1S/C4H7NO2/c6-4-5-2-1-3-7-4/h1-3H2,(H,5,6)
InChI Key	OYELEBBISJGNHJ-UHFFFAOYSA-N
MDL Number	MFCD11109147
Molecular Formula	C4H7NO2
Molecular Weight	101.1039
SMILES	O=C1OCCCN1
Synonyms	1,3-oxazinan-2-one, 5259-97-2, 2H-1,3-oxazin-2-one, tetrahydro-, tetrahydro-2H-1,3-Oxazin-2-one, [1,3]oxazinan-2-one, AC1LD2ZD, ACMC-209l0e, SCHEMBL13563, CTK1G2413, DTXSID80348917, OYELEBBISJGNHJ-UHFFFAOYSA-N, 1,3-Oxazinan-2-one, AldrichCPR, KS-00000E6K, ANW-31500, MFCD11109147, STL301675, ZINC26479256, AKOS006308430, MCULE-9333383492, TRA0036466, AJ-82457, CJ-17482, CS-11107, SY005699, AB0063976, AB1000550, DB-071552, TX-015844, CS-0088044, FT-0733046, ST24036820, V6397, K-9589, MFCD11109147 (95+%), I14-17349, Z1696871311, InChI=1/C4H7NO2/c6-4-5-2-1-3-7-4/h1-3H2,(H,5,6, null, trimethylene urethane, C4H7NO2, CID641496,

Complexity	81.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	101.048g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	101.105g/mol
Monoisotopic Mass	101.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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