AG000L8E

1239319-91-5 | 6-Boc-2-hydroxy-6-aza-spiro[3.4]octane

AG000L8E

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CAS Number	1239319-91-5
Catalog Number	AG000L8E(AGN-PC-0IJ4BT)
Chemical Name	6-Boc-2-hydroxy-6-aza-spiro[3.4]octane
IUPAC Name	tert-butyl 2-hydroxy-6-azaspiro[3.4]octane-6-carboxylate
InChI	InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-5-4-12(8-13)6-9(14)7-12/h9,14H,4-8H2,1-3H3
InChI Key	KAVBYCOMZDNOFX-UHFFFAOYSA-N
MDL Number	MFCD18073249
Molecular Formula	C12H21NO3
Molecular Weight	227.3000
SMILES	OC1CC2(C1)CCN(C2)C(=O)OC(C)(C)C
Synonyms	1239319-91-5, tert-Butyl 2-hydroxy-6-azaspiro[3.4]octane-6-carboxylate, 6-Boc-2-hydroxy-6-aza-spiro[3.4]octane, N-BOC-6-AZASPIRO[3.4]OCTAN-2-OL, 6-N-Boc-2-hydroxy-6-aza-spiro[3.4]octane, 145283-19-8, 1-N-Boc-6-azaspiro[3.4]octan-2-ol, SCHEMBL6114742, CTK8B9049, DTXSID50741092, KAVBYCOMZDNOFX-UHFFFAOYSA-N, ANW-61905, MFCD18073249, ZINC82049877, 6-Boc-6-azaspiro[3.4]octan-2-ol, AKOS016004990, CB-3810, CS-W022990, FCH1620133, PB16742, KS-000006S0, AK-87271, AS-30921, OR317097, AB0069420, AJ-125039, AX8236310, TC-150650, 4CH-011977, FT-0758404, ST24025856, Z4010, Q-3862, Tert-butyl 2-hydroxy-6-aza-spiro[3.4]octane-6-carboxylate, 6-AZASPIRO[3.4]OCTANE-6-CARBOXYLIC ACID, 2-HYDROXY-, 1,1-DIMETHYLETHYL ESTER, C12H21NO3,

Complexity	289
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.152g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	227.304g/mol
Monoisotopic Mass	227.152g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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