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Home Carboxys 2-Oxo-2,5-dihydro-pyrrole-1-carboxylic acid tert-butyl ester

2-Oxo-2,5-dihydro-pyrrole-1-carboxylic acid tert-butyl ester

CAS No.:
141293-14-3
Catalog Number:
AG007ZGO
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$238
- +
10g
98%
In Stock USA
United States
$434
- +
25g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG007ZGO
Chemical Name:
2-Oxo-2,5-dihydro-pyrrole-1-carboxylic acid tert-butyl ester
CAS Number:
141293-14-3
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
MDL Number:
MFCD01318910
IUPAC Name:
tert-butyl 5-oxo-2H-pyrrole-1-carboxylate
InChI:
InChI=1S/C9H13NO3/c1-9(2,3)13-8(12)10-6-4-5-7(10)11/h4-5H,6H2,1-3H3
InChI Key:
MFJKZXLOHPVLBS-UHFFFAOYSA-N
SMILES:
O=C(N1CC=CC1=O)OC(C)(C)C
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
5-Hydroxyalkyl derivatives of tert-butyl 2-oxo-2,5-dihydro-1H-pyrrole-1-carboxylate: diastereoselectivity of the Mukaiyama crossed-aldol-type reaction. Acta crystallographica. Section C, Crystal structure communications 20090401
Vicarious silylative Mukaiyama aldol reaction: a vinylogous extension. The Journal of organic chemistry 20080718
Properties