AG005G1Q

77745-32-5 | 8-Oxabicyclo[3.2.1]octan-3-one

AG005G1Q

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CAS Number	77745-32-5
Catalog Number	AG005G1Q(AGN-PC-00H0OZ)
Chemical Name	8-Oxabicyclo[3.2.1]octan-3-one
IUPAC Name	8-oxabicyclo[3.2.1]octan-3-one
InChI	InChI=1S/C7H10O2/c8-5-3-6-1-2-7(4-5)9-6/h6-7H,1-4H2
InChI Key	XWUJGUIPMCLRBE-UHFFFAOYSA-N
MDL Number	MFCD23106461
Molecular Formula	C7H10O2
Molecular Weight	126.1531
SMILES	O=C1CC2OC(C1)CC2
Synonyms	8-Oxabicyclo[3.2.1]octan-3-one, 77745-32-5, SCHEMBL926626, CTK2G6105, DTXSID70525311, XWUJGUIPMCLRBE-UHFFFAOYSA-N, 8-oxa-bicyclo[3.2.1]octan-3-one, 8-Oxabicyclo[3.2.1]octane-3-one, MFCD23106461, AKOS024124305, FCH1842277, PB37880, SB10891, AK170364, AS-33875, SC-51298, CS-0049936, KS-00000463, Q-5001, A839179, F8880-1858,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.068g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	126.155g/mol
Monoisotopic Mass	126.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number