AG00F9BN

637039-01-1 | tert-butyl 6-oxa-2,9-diazaspiro[4.5]decane-9-carboxylate

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CAS Number	637039-01-1
Catalog Number	AG00F9BN(AGN-PC-0T9LPG)
Chemical Name	tert-butyl 6-oxa-2,9-diazaspiro[4.5]decane-9-carboxylate
IUPAC Name	tert-butyl 6-oxa-2,9-diazaspiro[4.5]decane-9-carboxylate
InChI	InChI=1S/C12H22N2O3/c1-11(2,3)17-10(15)14-6-7-16-12(9-14)4-5-13-8-12/h13H,4-9H2,1-3H3
InChI Key	VESCRSHLXRKQFF-UHFFFAOYSA-N
MDL Number	MFCD18792931
Molecular Formula	C12H22N2O3
Molecular Weight	242.3147
SMILES	O=C(N(C1)CCOC21CCNC2)OC(C)(C)C
Synonyms	tert-butyl 6-oxa-2,9-diazaspiro[4.5]decane-9-carboxylate, 637039-01-1, AK171104, SCHEMBL13116090, KS-000004SY, MFCD18792931, AKOS022682613, FCH1631350, AS-51344, 9-Boc-6-oxa-2,9-diazaspiro[4.5]decane, CS-0048154, FT-0723092, tert-Butyl 10-oxa-3,7-diazaspiro[4.5]decane-7-carboxylate, 3-BROMO-4-CYANOBENZOIC ACID, 6-Oxa-2,9-diazaspiro[4.5]decane-9-carboxylic acid 1,1-dimethylethyl ester,

Complexity	301
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.163g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.319g/mol
Monoisotopic Mass	242.163g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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