AG003SVH

32499-64-2 | Ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

AG003SVH

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CAS Number	32499-64-2
Catalog Number	AG003SVH(AGN-PC-0JQOT5)
Chemical Name	Ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate
IUPAC Name	ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate
InChI	InChI=1S/C10H15NO3/c1-2-14-10(13)11-7-3-4-8(11)6-9(12)5-7/h7-8H,2-6H2,1H3
InChI Key	ANEJUHJDPGTVIO-UHFFFAOYSA-N
MDL Number	MFCD00078171
Molecular Formula	C10H15NO3
Molecular Weight	197.2310
NSC Number	715574
SMILES	O=C(N1C2CC(CC1CC2)=O)OCC
Synonyms	32499-64-2, ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate, N-(Ethoxycarbonyl)nortropinone, N-Carbethoxy-4-nortropinone, AK-54561, 8-Azabicyclo[3.2.1]octane-8-carboxylic acid, 3-oxo-, ethyl ester, 8-(Ethoxycarbonyl)-8-azabicyclo[3.2.1]octan-3-one, 3-Oxo-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester, 8-Ethoxycarbonyl-8-azabicyclo[3.2.1)octane-3-one, 8-Ethoxycarbonyl-8-azabicyclo[3.2.1]octane-3-one, MFCD00078171, NSC715574, N-Carbethoxynortropinone, AC1L8IGC, AC1Q6EHE, N-(Carboethoxy)nortropinone, 8-carbethoxynortropan-3-one, SCHEMBL1016674, CTK4G8793, DTXSID50328024, ANEJUHJDPGTVIO-UHFFFAOYSA-N, ANW-42275, AKOS015950489, AC-4295, FCH1679043, NSC-715574, VZ32978, KS-000007V9, DS-14567, SY004644, AB1000166, AX8012307, TR-030687, E0834, FT-0629282, ST50825417, W5430, MFCD00078171 (97+%), 8-Ethoxycarbonyl-8-azabicyclo[3.2.1]octan-3-one, 8-ethoxycarbonyl-8-azabicyclo-[3.2.1]octane-3-one, ethyl 8-aza-3-oxobicyclo[3.2.1]octane-8-carboxylate, 8-azabicyclo[3,2,1]octan-3-one-8-carboxylic acid ethyl ester, 3-oxo-8-aza-bicyclo[3.2.1]octane-8-carboxylic acid ethyl ester, 8-Azabicyclo[3.2.1]octane-8-carboxylicacid, 3-oxo-, ethyl ester, N-Carbethoxy-4-tropinone, C10H15NO3, AR-1I8906, CID401882, 32732-51-7,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.105g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	197.234g/mol
Monoisotopic Mass	197.105g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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