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Home > Pyridines > 898271-45-9
898271-45-9 | TERT-BUTYL N-[1-(PYRIDIN-2-YL)AZETIDIN-3-YL]CARBAMATE
CAS No: 898271-45-9 Catalog No: AG01DWSZ MDL No:MFCD21602227
Product Description
Catalog Number:
AG01DWSZ
Chemical Name:
TERT-BUTYL N-[1-(PYRIDIN-2-YL)AZETIDIN-3-YL]CARBAMATE
CAS Number:
898271-45-9
Molecular Formula:
C13H19N3O2
Molecular Weight:
249.3089
MDL Number:
MFCD21602227
IUPAC Name:
tert-butyl N-(1-pyridin-2-ylazetidin-3-yl)carbamate
InChI:
InChI=1S/C13H19N3O2/c1-13(2,3)18-12(17)15-10-8-16(9-10)11-6-4-5-7-14-11/h4-7,10H,8-9H2,1-3H3,(H,15,17)
InChI Key:
DJXNRCWSAHCRKC-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CN(C1)c1ccccn1
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.148g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.314g/mol
Monoisotopic Mass:
249.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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