Home Carboxys Cis-1-((benzyloxy)carbonyl)-4-ethylpyrrolidine-3-carboxylicacid

Cis-1-((benzyloxy)carbonyl)-4-ethylpyrrolidine-3-carboxylicacid

CAS No.:
1428243-23-5
Catalog Number:
AG01DIN8
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
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Product Description
Catalog Number:
AG01DIN8
Chemical Name:
Cis-1-((benzyloxy)carbonyl)-4-ethylpyrrolidine-3-carboxylicacid
CAS Number:
1428243-23-5
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD30861467
IUPAC Name:
(3R,4S)-4-ethyl-1-phenylmethoxycarbonylpyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C15H19NO4/c1-2-12-8-16(9-13(12)14(17)18)15(19)20-10-11-6-4-3-5-7-11/h3-7,12-13H,2,8-10H2,1H3,(H,17,18)/t12-,13+/m1/s1
InChI Key:
LKPALAXKZXXURJ-OLZOCXBDSA-N
SMILES:
CC[C@@H]1CN(C[C@@H]1C(=O)O)C(=O)OCc1ccccc1
EC Number:
820-324-3
Properties
Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties