AG003FCK

4423-79-4 | 1,4-Dioxaspiro[4.5]decan-2-one

AG003FCK

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CAS Number	4423-79-4
Catalog Number	AG003FCK(AGN-PC-0JSN12)
Chemical Name	1,4-Dioxaspiro[4.5]decan-2-one
IUPAC Name	1,4-dioxaspiro[4.5]decan-3-one
InChI	InChI=1S/C8H12O3/c9-7-6-10-8(11-7)4-2-1-3-5-8/h1-6H2
InChI Key	HBGAMCTZOLJGAS-UHFFFAOYSA-N
MDL Number	MFCD00010852
Molecular Formula	C8H12O3
Molecular Weight	156.1791
SMILES	O=C1OC2(CCCCC2)OC1
Synonyms	1,4-Dioxaspiro[4.5]decan-2-one, 4423-79-4, 2,2-Pentamethylene-1,3-dioxolan-4-one, AC1LBXLE, SCHEMBL1133003, CTK4I8039, DTXSID60337723, HBGAMCTZOLJGAS-UHFFFAOYSA-N, 1,4-dioxaspiro[4.5]decan-3-one, ZINC2167050, 1,4-Dioxaspiro[4.5]-2-decanone, 1,4-Dioxaspiro(4.5)decane-2-one, MFCD00010852, AKOS015912594, 1,4-Dioxaspiro[4.5]decan-2-one #, ACM4423794, FCH1115387, MCULE-2313287382, KS-000013Z5, CJ-33385, 1,4-Dioxaspiro[4.5]decan-2-one, 95%, FT-0635284, P1019, ST50997647, C-03540, I14-47912, CID544223,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.079g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	156.181g/mol
Monoisotopic Mass	156.079g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number