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1257294-07-7 | 1-Azetidinecarboxylic acid, 3-(2-oxo-1-pyrrolidinyl)-, 1,1-dimethylethyl ester
CAS No: 1257294-07-7 Catalog No: AG000OK0 MDL No:
Product Description
Catalog Number:
AG000OK0
Chemical Name:
1-Azetidinecarboxylic acid, 3-(2-oxo-1-pyrrolidinyl)-, 1,1-dimethylethyl ester
CAS Number:
1257294-07-7
Molecular Formula:
C12H20N2O3
Molecular Weight:
240.2988
IUPAC Name:
tert-butyl 3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxylate
InChI:
InChI=1S/C12H20N2O3/c1-12(2,3)17-11(16)13-7-9(8-13)14-6-4-5-10(14)15/h9H,4-8H2,1-3H3
InChI Key:
BEJHYAMGEUKMJA-UHFFFAOYSA-N
SMILES:
O=C(N1CC(C1)N1CCCC1=O)OC(C)(C)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.303g/mol
Monoisotopic Mass:
240.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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