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887581-35-3 | 1-Azetidinecarboxylicacid, 3-[(3-methoxypropyl)amino]-, 1,1-dimethylethyl ester
CAS No: 887581-35-3 Catalog No: AG004EB5 MDL No:
Product Description
Catalog Number:
AG004EB5
Chemical Name:
1-Azetidinecarboxylicacid, 3-[(3-methoxypropyl)amino]-, 1,1-dimethylethyl ester
CAS Number:
887581-35-3
Molecular Formula:
C12H24N2O3
Molecular Weight:
244.3306
IUPAC Name:
tert-butyl 3-(3-methoxypropylamino)azetidine-1-carboxylate
InChI:
InChI=1S/C12H24N2O3/c1-12(2,3)17-11(15)14-8-10(9-14)13-6-5-7-16-4/h10,13H,5-9H2,1-4H3
InChI Key:
VONDATHCZLSBCB-UHFFFAOYSA-N
SMILES:
COCCCNC1CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.179g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.335g/mol
Monoisotopic Mass:
244.179g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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