AG000AT0

114214-49-2 | 6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid, 1,1-dimethylethyl ester

AG000AT0

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CAS Number	114214-49-2
Catalog Number	AG000AT0(AGN-PC-0A9O7O)
Chemical Name	6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
InChI	InChI=1S/C9H15NO3/c1-9(2,3)13-8(11)10-4-6-7(5-10)12-6/h6-7H,4-5H2,1-3H3
InChI Key	NXZIGGBPLGAPTI-UHFFFAOYSA-N
MDL Number	MFCD08691407
Molecular Formula	C9H15NO3
Molecular Weight	185.2203
SMILES	C12CN(CC2O1)C(=O)OC(C)(C)C
Synonyms	114214-49-2, tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, 3-Boc-6-oxa-3-aza-bicyclo[3.1.0]hexane, 3-Boc-6-oxa-3-azabicyclo[3.1.0]hexane, 6-Oxa-3-aza-bicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester, 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester, NXZIGGBPLGAPTI-UHFFFAOYSA-N, tert-Butyl 6-oxa-3-aza-bicyclo[3.1.0]hexane-3-carboxylate, MFCD08691407, 6-oxa-3-aza-bicyclo[, AC1Q1MYG, N-boc-3,4-epoxypyrrolidine, 1-Boc-3,4-epoxypyrrolidine, KSC508M4H, 3-boc-6-oxa-3-azabicyclo[, SCHEMBL376518, (1S,5R)-tert-Butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, 3-boc-6-oxa-3-aza-bicyclo[, CTK4A8643, tert-butyl 6-oxa-3-azabicyclo[, DTXSID90435605, tert-butyl6-oxa-3-aza-bicyclo[3.1.0]hexane-3-carboxylate, tert-butyl 6-oxa-3-aza-bicyclo[, ALBB-007821, CS-D0109, ANW-50648, STK504827, 1-t-butoxycarbonyl-3-epoxypyrrolidine, 6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid, 1,1-dimethylethyl ester, AKOS005171678, CB-3187, LS40401, MCULE-3674956735, PB17572, QC-3929, RP24537, RTR-002663, SS-4524, TRA0070583, WT80708, KS-0000041F, 1-t-butoxycarbonyl-3,4-epoxypyrrolidine, AK-50527, AN-33307, BP-21205, BR-50527, SC-32976, SY021365, 1-tert-butoxycarbonyl-3,4-epoxypyrrolidine, 1-tert-butoxycarbonyl-3.4-epoxypyrrolidine, AB0034856, DB-012070, ST1030177, TR-002663, 4CH-000350, A2325, AM20080085, BB 0253897, FT-0679356, X9080, 1-(tert-Butoxycarbonyl)-3,4-epoxypyrrolidine, EN300-27365, tert-butyl 3,4-Epoxypyrrolidine-1-carboxylate, S-4490, MFCD08691407 (97+%), 214B492, I14-8841, J-511775, F8881-7875, 3-(tert-Butoxycarbonyl)-3-aza-6-oxabicyclo[3.1.0]hexane, tert-Butyl6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, 1-tert-butyl-6-oxa-3-aza-bicyclo[3.1.0]hexane-3-carboxylate, 1,1-dimethylethyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, 3[(1,1-Dimethylethoxy)carbonyl]-6-oxa-3-azabicyclo[3.1.0]hexane, 6-Oxa-3-aza-bicyclo[3.1.0]hexane-3-carboxylic acid, tert-butyl ester, C9H15NO3, ACN-036730, CID10103880, B5385, (1R,5S)-tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, (S)-1-[(RP)-2-(Dicyclohexylphosphino)ferrocenyl]ethyldi-tert-butylphosphine, tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate, 95% - 1G 1g, 106447-97-6, N/A,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.105g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.223g/mol
Monoisotopic Mass	185.105g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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