AG003AXV

36929-66-5 | 1-Oxaspiro[2.5]octane-2-carbonitrile

AG003AXV

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CAS Number	36929-66-5
Catalog Number	AG003AXV(AGN-PC-0JSPSO)
Chemical Name	1-Oxaspiro[2.5]octane-2-carbonitrile
IUPAC Name	1-oxaspiro[2.5]octane-2-carbonitrile
InChI	InChI=1S/C8H11NO/c9-6-7-8(10-7)4-2-1-3-5-8/h7H,1-5H2
InChI Key	XHQXDTZBGXZOTI-UHFFFAOYSA-N
MDL Number	MFCD00101211
Molecular Formula	C8H11NO
Molecular Weight	137.1790
SMILES	N#CC1OC12CCCCC2
Synonyms	1-Oxaspiro[2.5]octane-2-carbonitrile, 36929-66-5, 1-Oxaspiro[2.5]octane-2-carbonitrile, (-)-, XHQXDTZBGXZOTI-UHFFFAOYSA-N, MFCD00101211, AC1LC6R5, 500899-63-8, SCHEMBL5852885, CTK1B6010, DTXSID90338405, 2-oxaspiro[2.5]octanecarbonitrile, KS-000010AP, 1774AE, SBB056231, 1-oxaspiro[2.5]octan-2-kohlenitrile, AKOS022504570, 1-oxaspiro[2,5]octane-2-carbonitrile, 2-oxaspiro[2.5]octane-1-carbonitrile, PS-10258, DB-004781, FT-0736533, ST24038159, C8H11NO, CID548939, ZINC00162232, ACN-043733, 1-Oxaspiro[2.5]octane-2-carbonitrile, -, 1-Oxaspiro[2.5]octane-2-carbonitrile, (+)-, 1-Oxaspiro[2.5]octane-2-carbonitrile (6CI, 9CI), 500899-64-9,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.084g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	137.182g/mol
Monoisotopic Mass	137.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number