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102153-86-6 | 3-Pyrrolidinone, 1-ethyl-
CAS No: 102153-86-6 Catalog No: AG0006RZ MDL No:MFCD11640506
Product Description
Catalog Number:
AG0006RZ
Chemical Name:
3-Pyrrolidinone, 1-ethyl-
CAS Number:
102153-86-6
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
MDL Number:
MFCD11640506
IUPAC Name:
1-ethylpyrrolidin-3-one
InChI:
InChI=1S/C6H11NO/c1-2-7-4-3-6(8)5-7/h2-5H2,1H3
InChI Key:
XXXQFHALDVELNQ-UHFFFAOYSA-N
SMILES:
CCN1CCC(=O)C1
NSC Number:
318727
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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