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483366-12-7 | (2S,4R);-tert-Butyl 2-cyano-4-hydroxypyrrolidine-1-carboxylate
CAS No: 483366-12-7 Catalog No: AG003BPD MDL No:MFCD09863132
Product Description
Catalog Number:
AG003BPD
Chemical Name:
(2S,4R);-tert-Butyl 2-cyano-4-hydroxypyrrolidine-1-carboxylate
CAS Number:
483366-12-7
Molecular Formula:
C10H16N2O3
Molecular Weight:
212.2456
MDL Number:
MFCD09863132
IUPAC Name:
tert-butyl (2S,4R)-2-cyano-4-hydroxypyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H16N2O3/c1-10(2,3)15-9(14)12-6-8(13)4-7(12)5-11/h7-8,13H,4,6H2,1-3H3/t7-,8+/m0/s1
InChI Key:
UNVNZVOSYRUJTH-JGVFFNPUSA-N
SMILES:
O[C@@H]1C[C@H](N(C1)C(=O)OC(C)(C)C)C#N
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
212.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.249g/mol
Monoisotopic Mass:
212.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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