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1290821-13-4 | tert-Butyl 1-benzyloxycarbonylazetidine-2-carboxylate
CAS No: 1290821-13-4 Catalog No: AG01F884 MDL No:
Product Description
Catalog Number:
AG01F884
Chemical Name:
tert-Butyl 1-benzyloxycarbonylazetidine-2-carboxylate
CAS Number:
1290821-13-4
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
IUPAC Name:
1-O-benzyl 2-O-tert-butyl azetidine-1,2-dicarboxylate
InChI:
InChI=1S/C16H21NO4/c1-16(2,3)21-14(18)13-9-10-17(13)15(19)20-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3
InChI Key:
KGDVYAKZFWXQFT-UHFFFAOYSA-N
SMILES:
O=C(N1CCC1C(=O)OC(C)(C)C)OCc1ccccc1
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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