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139143-53-6 | 2-Pyrrolidinone, 1-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)-
CAS No: 139143-53-6 Catalog No: AG001ADY MDL No:
Product Description
Catalog Number:
AG001ADY
Chemical Name:
2-Pyrrolidinone, 1-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)-
CAS Number:
139143-53-6
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
IUPAC Name:
1-(adamantane-1-carbonyl)pyrrolidin-2-one
InChI:
InChI=1S/C15H21NO2/c17-13-2-1-3-16(13)14(18)15-7-10-4-11(8-15)6-12(5-10)9-15/h10-12H,1-9H2
InChI Key:
HGLVVWKWAQKMAH-UHFFFAOYSA-N
SMILES:
O=C1CCCN1C(=O)C12CC3CC(C2)CC(C1)C3
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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