AG00CITI

40369-91-3 | 1,4-Dioxa-7-aza-spiro[4.5]decane

AG00CITI

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CAS Number	40369-91-3
Catalog Number	AG00CITI(AGN-PC-0NIW3E)
Chemical Name	1,4-Dioxa-7-aza-spiro[4.5]decane
IUPAC Name	1,4-dioxa-9-azaspiro[4.5]decane
InChI	InChI=1S/C7H13NO2/c1-2-7(6-8-3-1)9-4-5-10-7/h8H,1-6H2
InChI Key	FZWPOVPBHOSLFN-UHFFFAOYSA-N
MDL Number	MFCD11858448
Molecular Formula	C7H13NO2
Molecular Weight	143.1836
SMILES	C1COC2(CCCNC2)O1
Synonyms	1,4-Dioxa-7-azaspiro[4.5]decane, 40369-91-3, 1,4-DIOXA-7-AZA-SPIRO[4.5]DECANE, SCHEMBL824576, CTK8B8228, KS-00000OOZ, DTXSID80496149, FZWPOVPBHOSLFN-UHFFFAOYSA-N, BCP05243, 1,4-Dioxa-7-aza-spiro[4.5decane, 5428AB, ANW-59721, MFCD11858448, ZINC39220129, AKOS006357492, CS-W004885, MCULE-5715340842, 1,4-Dioxa-7-aza-spiro [4.5] decane, AJ-99179, AK-39561, DB-070001, ST2403011, TC-148466, 4CH-000406, FT-0762529, Z-6560, Z1473994468, C7H13NO2, ACN-030129,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.095g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.186g/mol
Monoisotopic Mass	143.095g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	30.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number