AG003ESL

75233-61-3 | 2-(2-Nitroethoxy)tetrahydropyran ,

AG003ESL

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CAS Number	75233-61-3
Catalog Number	AG003ESL(AGN-PC-0JVO6W)
Chemical Name	2-(2-Nitroethoxy)tetrahydropyran ,
IUPAC Name	2-(2-nitroethoxy)oxane
InChI	InChI=1S/C7H13NO4/c9-8(10)4-6-12-7-3-1-2-5-11-7/h7H,1-6H2
InChI Key	KQDXRRAVDLIMGM-UHFFFAOYSA-N
MDL Number	MFCD09728790
Molecular Formula	C7H13NO4
Molecular Weight	175.1824
SMILES	O=[N+](CCOC1CCCCO1)[O-]
Synonyms	2-(2-Nitroethoxy)tetrahydropyran, 75233-61-3, 2-(2-nitroethoxy)tetrahydro-2H-pyran, Tetrahydro-2-(2-nitroethoxy)-2H-pyran, ACMC-209oxj, 2H-Pyran, tetrahydro-2-(2-nitroethoxy)-, 2-(2-nitroethoxy)oxane, AC1MWG32, SCHEMBL1220417, CTK5E1318, DTXSID40395886, KQDXRRAVDLIMGM-UHFFFAOYSA-N, 2-(2-nitroethoxy) tetrahydropyran, ANW-36581, MFCD00010858, AKOS015912830, MCULE-3971907968, 2H-Pyran,tetrahydro-2-(2-nitroethoxy)-, CC-05527, 2-[(2-nitroethyl)oxy]tetrahydro-2H-pyran, DB-055946, TC-125326, FT-0608503, N0602, ST50998293, 1-nitro-2-(tetrahydro-2H-pyran-2-yloxy)ethane, C-05990, I14-47623, 1-(2H-3,4,5,6-tetrahydropyran-2-yloxy)-2-nitroethane, ZINC00155437, CID3748656,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.184g/mol
Monoisotopic Mass	175.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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