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1417789-79-7 | 1-Pyrrolidinecarboxylic acid, 3-(2-pyridinyloxy)-, 1,1-dimethylethyl ester, (3R)-
CAS No: 1417789-79-7 Catalog No: AG001H2C MDL No:MFCD21606421
Product Description
Catalog Number:
AG001H2C
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-(2-pyridinyloxy)-, 1,1-dimethylethyl ester, (3R)-
CAS Number:
1417789-79-7
Molecular Formula:
C14H20N2O3
Molecular Weight:
264.3202
MDL Number:
MFCD21606421
IUPAC Name:
tert-butyl (3R)-3-pyridin-2-yloxypyrrolidine-1-carboxylate
InChI:
InChI=1S/C14H20N2O3/c1-14(2,3)19-13(17)16-9-7-11(10-16)18-12-6-4-5-8-15-12/h4-6,8,11H,7,9-10H2,1-3H3/t11-/m1/s1
InChI Key:
YDBUDAIEOISMCW-LLVKDONJSA-N
SMILES:
O=C(N1CC[C@H](C1)Oc1ccccn1)OC(C)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
264.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.325g/mol
Monoisotopic Mass:
264.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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