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114825-49-9 | 2-Pyrrolidinone, 1-(diphenylphosphino)-
CAS No: 114825-49-9 Catalog No: AG000FB1 MDL No:
Product Description
Catalog Number:
AG000FB1
Chemical Name:
2-Pyrrolidinone, 1-(diphenylphosphino)-
CAS Number:
114825-49-9
Molecular Formula:
C16H16NOP
Molecular Weight:
269.2781
IUPAC Name:
1-diphenylphosphanylpyrrolidin-2-one
InChI:
InChI=1S/C16H16NOP/c18-16-12-7-13-17(16)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChI Key:
SYCDLOGZQHYXKK-UHFFFAOYSA-N
SMILES:
O=C1CCCN1P(c1ccccc1)c1ccccc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.097g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.284g/mol
Monoisotopic Mass:
269.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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