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887581-27-3 | 1-Azetidinecarboxylicacid, 3-[(2-methoxyethyl)amino]-, 1,1-dimethylethyl ester
CAS No: 887581-27-3 Catalog No: AG004CE7 MDL No:
Product Description
Catalog Number:
AG004CE7
Chemical Name:
1-Azetidinecarboxylicacid, 3-[(2-methoxyethyl)amino]-, 1,1-dimethylethyl ester
CAS Number:
887581-27-3
Molecular Formula:
C11H22N2O3
Molecular Weight:
230.3040
IUPAC Name:
tert-butyl 3-(2-methoxyethylamino)azetidine-1-carboxylate
InChI:
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(14)13-7-9(8-13)12-5-6-15-4/h9,12H,5-8H2,1-4H3
InChI Key:
PJWMAVJTLVIWPJ-UHFFFAOYSA-N
SMILES:
COCCNC1CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.308g/mol
Monoisotopic Mass:
230.163g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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