Home Carboxys tert-Butyl1-Cbz-pyrrolidine-3-carboxylate

tert-Butyl1-Cbz-pyrrolidine-3-carboxylate

CAS No.:
1820675-44-2
Catalog Number:
AG00I0SJ
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
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Product Description
Catalog Number:
AG00I0SJ
Chemical Name:
tert-Butyl1-Cbz-pyrrolidine-3-carboxylate
CAS Number:
1820675-44-2
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
MDL Number:
MFCD27959535
IUPAC Name:
1-O-benzyl 3-O-tert-butyl pyrrolidine-1,3-dicarboxylate
InChI:
InChI=1S/C17H23NO4/c1-17(2,3)22-15(19)14-9-10-18(11-14)16(20)21-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3
InChI Key:
JCJWUFNTUBAWTN-UHFFFAOYSA-N
SMILES:
O=C(C1CCN(C1)C(=O)OCc1ccccc1)OC(C)(C)C
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.163g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.374g/mol
Monoisotopic Mass:
305.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties