Home Carboxys 2-benzyl 1-tert-butyl pyrrolidine-1,2-dicarboxylate

2-benzyl 1-tert-butyl pyrrolidine-1,2-dicarboxylate

CAS No.:
2089093-10-5
Catalog Number:
AG01B5GN
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
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Product Description
Catalog Number:
AG01B5GN
Chemical Name:
2-benzyl 1-tert-butyl pyrrolidine-1,2-dicarboxylate
CAS Number:
2089093-10-5
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
MDL Number:
MFCD24387973
IUPAC Name:
2-O-benzyl 1-O-tert-butyl pyrrolidine-1,2-dicarboxylate
InChI:
InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-11-7-10-14(18)15(19)21-12-13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3
InChI Key:
DFBLOFPQNCBVTI-UHFFFAOYSA-N
SMILES:
O=C(C1CCCN1C(=O)OC(C)(C)C)OCc1ccccc1
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:
3  
Properties