AG003STZ

188975-88-4 | tert-Butyl 4-oxoazepane-1-carboxylate

AG003STZ

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CAS Number	188975-88-4
Catalog Number	AG003STZ(AGN-PC-0K69EY)
Chemical Name	tert-Butyl 4-oxoazepane-1-carboxylate
IUPAC Name	tert-butyl 4-oxoazepane-1-carboxylate
InChI	InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-7-4-5-9(13)6-8-12/h4-8H2,1-3H3
InChI Key	PMLBUVZPRKXMOX-UHFFFAOYSA-N
MDL Number	MFCD03788435
Molecular Formula	C11H19NO3
Molecular Weight	213.2735
SMILES	C(C)(C)(C)OC(=O)N1CCCC(CC1)=O
Synonyms	188975-88-4, Tert-butyl 4-oxoazepane-1-carboxylate, N-Boc-hexahydro-1H-azepin-4-one, 1-Boc-hexahydro-1H-azepin-4-one, 4-Oxoazepane-1-carboxylic acid tert-butyl ester, 1-Boc-homopiperazin-4-one, 1-BOC-4-AZEPANONE, N-Boc-hexahydro-1H-azepine-4-one, MFCD03788435, 4-Oxo-azepane-1-carboxylic acid tert-butyl ester, tert-Butyl hexahydro-4-oxo-1H-azepine-1-carboxylate, N-BOC-Hexahydro-1H-azepin-4-one, 97%, AC1LTQMR, PubChem17359, 4-N-Boc-hexahydroazepinone, 1-boc-homopipoerazin-4-one, KSC496K4N, SCHEMBL157123, Jsp003880, CTK3J6546, DTXSID00363768, PMLBUVZPRKXMOX-UHFFFAOYSA-N, ACT09106, CS-D0285, t-Butyl 4-oxoazepane-1-carboxylate, ZINC1433369, AN-111, ANW-51050, CB0205, RW3005, SBB094816, tert-butyl 4-oxo-1-azepancarboxylate, tert-Butyl 4-oxoazepane-1-carboxylat, tert-butyl 4-oxoazepane-l-carboxylate, 1-(tert-Butoxycarbonyl)-4-oxoazepane, 1-t-butoxycarbonyl-4-oxohomopiperidine, AKOS015841230, tert-butyl 4-oxo-azepan-1-carboxylate, AC-2977, CB-1919, MCULE-1084181433, PB23364, PS-5153, QC-2063, RP07454, RTC-061354, TRA-0191133, 1-(t-butoxycarbonyl)-4-perhydroazepinone, AJ-25928, AK-21778, BR-21778, CJ-23405, EN000298, SC-25013, SY003473, tert-butyl 4-oxoazaperhydroepinecarboxylate, AB0033497, AB1006302, DB-031162, N-tert-butoxycarbonyl-hexahydroazepin-4-one, ST1261386, TC-061354, 4CH-002150, AM20090105, FT-0084317, FT-0648460, X7060, B34052, C-6352, MFCD03788435 (97+%), 975B884, I14-2847, N-(tert-butoxycarbonyl)-hexahydro-1H-azepin-4-one, t-Butyl hexahydro-4-oxo-(4H)-azepine-1-carboxylate, W-206389, 1-(tert-butyloxycarbonyl)-hexahydro-4 H-azepin-4-one, N-Boc-hexahydro-1H-azepin-4-one, >=95.0% (HPLC), F2158-1558, 4-Oxohexahydro-1H-azepine-1-carboxylic acid tert-butyl ester, 1,1-DIMETHYLETHYL 4-OXOHEXAHYDRO-1H-AZEPINE-1-CARBOXYLATE, 1-Boc-homopiperazin-4-one; tert-Butyl hexahydro-4-oxo-1H-azepine-1-carboxylate, C11H19NO3, ACN-039558, CID1512679, A4176, 1H-AZEPINE-1-CARBOXYLIC ACID, HEXAHYDRO-4-OXO-, 1,1-DIMETHYLETHYL ESTER,

Complexity	255
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.136g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	213.277g/mol
Monoisotopic Mass	213.136g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number