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17771-41-4 | 2-Pyrrolidinone, 5-propyl-
CAS No: 17771-41-4 Catalog No: AG0025GU MDL No:
Product Description
Catalog Number:
AG0025GU
Chemical Name:
2-Pyrrolidinone, 5-propyl-
CAS Number:
17771-41-4
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
IUPAC Name:
5-propylpyrrolidin-2-one
InChI:
InChI=1S/C7H13NO/c1-2-3-6-4-5-7(9)8-6/h6H,2-5H2,1H3,(H,8,9)
InChI Key:
IRGZEUUQSUZQJA-UHFFFAOYSA-N
SMILES:
CCCC1CCC(=O)N1
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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