AG001QC9

158602-43-8 | 1-Azetidinecarboxylic acid, 3-(3-hydroxypropyl)-, 1,1-dimethylethyl ester

AG001QC9

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CAS Number	158602-43-8
Catalog Number	AG001QC9(AGN-PC-025OEY)
Chemical Name	1-Azetidinecarboxylic acid, 3-(3-hydroxypropyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 3-(3-hydroxypropyl)azetidine-1-carboxylate
InChI	InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-7-9(8-12)5-4-6-13/h9,13H,4-8H2,1-3H3
InChI Key	GTUCWIHPIAGCEC-UHFFFAOYSA-N
MDL Number	MFCD18206284
Molecular Formula	C11H21NO3
Molecular Weight	215.2893
SMILES	O=C(N1CC(CCCO)C1)OC(C)(C)C
Synonyms	tert-Butyl 3-(3-hydroxypropyl)azetidine-1-carboxylate, 158602-43-8, SCHEMBL7401533, CTK4C9750, DTXSID30597579, 7961AA, MFCD18206284, ZINC71864468, AKOS015924506, FCH1623300, AK-93269, AS-49561, DA-09788, AJ-118965, AX8250388, ST2402051, 4CH-019447, FT-0728236, S-0212, t-Butyl 3-(3-hydroxypropyl)azetidine-1-carboxylate, 1-Azetidinecarboxylic acid, 3-(3-hydroxypropyl)-, 1,1-dimethylethyl ester, C11H21NO3, GTUCWIHPIAGCEC-UHFFFAOYSA-N,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.152g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.293g/mol
Monoisotopic Mass	215.152g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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