Home Carboxys tert-butyl 2-(4-methoxybenzoyl)pyrrolidine-1-carboxylate

tert-butyl 2-(4-methoxybenzoyl)pyrrolidine-1-carboxylate

CAS No.:
337368-53-3
Catalog Number:
AG01A11Y
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
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Product Description
Catalog Number:
AG01A11Y
Chemical Name:
tert-butyl 2-(4-methoxybenzoyl)pyrrolidine-1-carboxylate
CAS Number:
337368-53-3
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
MDL Number:
MFCD22392135
IUPAC Name:
tert-butyl 2-(4-methoxybenzoyl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-11-5-6-14(18)15(19)12-7-9-13(21-4)10-8-12/h7-10,14H,5-6,11H2,1-4H3
InChI Key:
PIHOJFAMQDWYCG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)C1CCCN1C(=O)OC(C)(C)C
Properties
Complexity:
407  
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:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties