sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Pyrrolidin-3-one

Pyrrolidin-3-one

CAS No.:
96-42-4
Catalog Number:
AG005ULH
Molecular Formula:
C4H7NO
Molecular Weight:
85.1045
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG005ULH
Chemical Name:
Pyrrolidin-3-one
CAS Number:
96-42-4
Molecular Formula:
C4H7NO
Molecular Weight:
85.1045
MDL Number:
MFCD07368170
IUPAC Name:
pyrrolidin-3-one
InChI:
InChI=1S/C4H7NO/c6-4-1-2-5-3-4/h5H,1-3H2
InChI Key:
QGKLPGKXAVVPOJ-UHFFFAOYSA-N
SMILES:
O=C1CNCC1
NSC Number:
31423
Properties
Complexity:
69.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.053g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
85.106g/mol
Monoisotopic Mass:
85.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Literature
Title Journal
(5E)-5-(2,4-Dichloro-benzyl-idene)-2-(piperidin-1-yl)-1,3-thia-zol-4(5H)-one. Acta crystallographica. Section E, Structure reports online 20111101
Highly active organocatalysts for asymmetric anti-Mannich reactions. Chemistry (Weinheim an der Bergstrasse, Germany) 20110801
(5E)-5-(4-Meth-oxy-benzyl-idene)-2-(piperidin-1-yl)-1,3-thia-zol-4(5H)-one. Acta crystallographica. Section E, Structure reports online 20110801
A facile synthesis and anticancer activity evaluation of spiro[thiazolidinone-isatin] conjugates. Scientia pharmaceutica 20110101
Aminodifluorosulfinium salts: selective fluorination reagents with enhanced thermal stability and ease of handling. The Journal of organic chemistry 20100521
Asymmetric synthesis of cis- and trans-2,5-disubstituted pyrrolidines from 3-oxo pyrrolidine 2-phosphonates: synthesis of (+)-preussin and analogs. Organic letters 20080403
Asymmetric hydrogenations one by one: differentiation of up to three beta-ketocarboxylic acid derivatives based on Ruthenium(II)-binap catalysis. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Properties