Home Carboxys ethyl 3-methyl-2-oxopyrrolidine-3-carboxylate

ethyl 3-methyl-2-oxopyrrolidine-3-carboxylate

CAS No.:
79232-62-5
Catalog Number:
AG01BA4M
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
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Product Description
Catalog Number:
AG01BA4M
Chemical Name:
ethyl 3-methyl-2-oxopyrrolidine-3-carboxylate
CAS Number:
79232-62-5
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
MDL Number:
MFCD24555621
IUPAC Name:
ethyl 3-methyl-2-oxopyrrolidine-3-carboxylate
InChI:
InChI=1S/C8H13NO3/c1-3-12-7(11)8(2)4-5-9-6(8)10/h3-5H2,1-2H3,(H,9,10)
InChI Key:
LDJOKVMAYHUXLD-UHFFFAOYSA-N
SMILES:
CC1(CCNC1=O)C(=O)OCC
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.196g/mol
Monoisotopic Mass:
171.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties