Home Other Building Blocks rac-tert-butyl N-{[(3R,4R)-4-ethoxypyrrolidin-3-yl]methyl}carbamate, trans

rac-tert-butyl N-{[(3R,4R)-4-ethoxypyrrolidin-3-yl]methyl}carbamate, trans

CAS No.:
1969287-93-1
Catalog Number:
AG01C5OP
Molecular Formula:
C12H24N2O3
Molecular Weight:
244.3306
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Product Description
Catalog Number:
AG01C5OP
Chemical Name:
rac-tert-butyl N-{[(3R,4R)-4-ethoxypyrrolidin-3-yl]methyl}carbamate, trans
CAS Number:
1969287-93-1
Molecular Formula:
C12H24N2O3
Molecular Weight:
244.3306
MDL Number:
MFCD30012452
IUPAC Name:
tert-butyl N-[[(3S,4S)-4-ethoxypyrrolidin-3-yl]methyl]carbamate
InChI:
InChI=1S/C12H24N2O3/c1-5-16-10-8-13-6-9(10)7-14-11(15)17-12(2,3)4/h9-10,13H,5-8H2,1-4H3,(H,14,15)/t9-,10+/m0/s1
InChI Key:
GNORXHTXMBLWJX-VHSXEESVSA-N
SMILES:
CCO[C@@H]1CNC[C@H]1CNC(=O)OC(C)(C)C
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
244.335g/mol
Monoisotopic Mass:
244.179g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties