AG00078S

1023595-19-8 | 2,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester

AG00078S

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CAS Number	1023595-19-8
Catalog Number	AG00078S(AGN-PC-0435OD)
Chemical Name	2,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 2,9-diazaspiro[5.5]undecane-9-carboxylate
InChI	InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-6-14(7-10-16)5-4-8-15-11-14/h15H,4-11H2,1-3H3
InChI Key	QDWTYWWOUAIWGI-UHFFFAOYSA-N
MDL Number	MFCD10700117
Molecular Formula	C14H26N2O2
Molecular Weight	254.3684
SMILES	O=C(N(CC1)CCC21CCCNC2)OC(C)(C)C
Synonyms	1023595-19-8, TERT-BUTYL 2,9-DIAZASPIRO[5.5]UNDECANE-9-CARBOXYLATE, 9-Boc-2,9-diazaspiro[5.5]undecane, 2,9-Diazaspiro[5.5]undecane-9-carboxylic acid tert-butyl ester, TERT-BUTYL 2,9-DIAZASPIRO [5.5]UNDECANE-9-CARBOXYLATE, 102359-51-3, SCHEMBL485160, CTK8B6763, DTXSID40677311, QDWTYWWOUAIWGI-UHFFFAOYSA-N, CS-D0621, KS-000006XJ, ANW-54259, MFCD10700117, WT1168, ZINC51943407, AKOS005259435, CB-3317, CM10411, GS-3660, RP07798, SB20125, 9-N-Boc-2,9-diazaspiro[5.5]undecane, AK-38905, AM802850, SC-48803, AB0039370, AJ-111809, DB-058804, DB-065687, TC-143004, FT-0648995, ST24045852, Y6824, Q-3417, 595B198, J-507548, W-204452, I14-11488, tert butyl 2,9-diazaspiro[5.5]undecane-9-carboxylate, tert-butyl 3,8-diazaspiro[5,5]undecane-3-carboxylate, tert-butyl 4,9-diazaspiro[5.5]undecane-9-carboxylate, TERT-BUTYL 2,9-DIAZASPIRO[5.5]UNDECANE-9-CARBOXYLA, 1023595-19-8 tert-butyl 2,9-diazaspiro[5.5]undecane-9-carboxylate, 2,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester, 1023595-19-8 2,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester, C14H26N2O2, (3R,5S)-3,5-Dimethylmorpholine, ACN-029458, R036, 2,9-diaza-spiro[5.5]undecane-9-carboxylic acid tert-butyl ester, 189333-03-7, 236406-48-7,

Complexity	301
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.199g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	254.374g/mol
Monoisotopic Mass	254.199g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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