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85760-88-9 | 2-Pyrrolidinecarboxamide,N,N-diethyl-5-oxo-, (2S)-
CAS No: 85760-88-9 Catalog No: AG004RZ4 MDL No:
Product Description
Catalog Number:
AG004RZ4
Chemical Name:
2-Pyrrolidinecarboxamide,N,N-diethyl-5-oxo-, (2S)-
CAS Number:
85760-88-9
Molecular Formula:
C9H16N2O2
Molecular Weight:
184.2355
IUPAC Name:
(2S)-N,N-diethyl-5-oxopyrrolidine-2-carboxamide
InChI:
InChI=1S/C9H16N2O2/c1-3-11(4-2)9(13)7-5-6-8(12)10-7/h7H,3-6H2,1-2H3,(H,10,12)/t7-/m0/s1
InChI Key:
IZCZSKAHNSOBSI-ZETCQYMHSA-N
SMILES:
CCN(C(=O)[C@@H]1CCC(=O)N1)CC
EC Number:
288-566-7
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
184.121g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.239g/mol
Monoisotopic Mass:
184.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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