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114676-67-4 | (2S,4R)-tert-Butyl 4-((tert-butyldimethylsilyl)oxy)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CAS No: 114676-67-4 Catalog No: AG003BPE MDL No:MFCD01862190
Product Description
Catalog Number:
AG003BPE
Chemical Name:
(2S,4R)-tert-Butyl 4-((tert-butyldimethylsilyl)oxy)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CAS Number:
114676-67-4
Molecular Formula:
C16H33NO4Si
Molecular Weight:
331.5230
MDL Number:
MFCD01862190
IUPAC Name:
tert-butyl (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C16H33NO4Si/c1-15(2,3)20-14(19)17-10-13(9-12(17)11-18)21-22(7,8)16(4,5)6/h12-13,18H,9-11H2,1-8H3/t12-,13+/m0/s1
InChI Key:
IIITUHPEBILIQR-QWHCGFSZSA-N
SMILES:
OC[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)O[Si](C(C)(C)C)(C)C
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
331.218g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.528g/mol
Monoisotopic Mass:
331.218g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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