AG0038EN

849671-56-3 | Spiro[2.5]octan-6-ylmethanol

AG0038EN

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CAS Number	849671-56-3
Catalog Number	AG0038EN(AGN-PC-09TQPI)
Chemical Name	Spiro[2.5]octan-6-ylmethanol
IUPAC Name	spiro[2.5]octan-6-ylmethanol
InChI	InChI=1S/C9H16O/c10-7-8-1-3-9(4-2-8)5-6-9/h8,10H,1-7H2
InChI Key	CPOBXDZHERXVFP-UHFFFAOYSA-N
MDL Number	MFCD11501505
Molecular Formula	C9H16O
Molecular Weight	140.2227
SMILES	OCC(CC1)CCC21CC2
Synonyms	Spiro[2.5]octan-6-ylmethanol, 849671-56-3, Spiro[2.5]oct-6-yl-methanol, Spiro[2.5]octane-6-methanol, spiro[2.5]oct-6-ylmethanol, (Spiro[2.5]octan-6-yl)methanol, {spiro[2.5]octan-6-yl}methanol, SCHEMBL3025238, CTK2I4756, KS-00000PRP, DTXSID60705241, CPOBXDZHERXVFP-UHFFFAOYSA-N, ACT10413, ANW-46588, MFCD11501505, ZINC44138824, AKOS006323330, QC-9540, AK-86635, DA-18321, DS-18201, AB0007574, AJ-109442, RT-024194, ST2407583, CS-0055026, FT-0709777, W8768, A-1932, F2147-8523, C9H16O,

Complexity	117
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.12g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.226g/mol
Monoisotopic Mass	140.12g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number