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1020718-50-6 | 2-Pyrrolidinone, 4-(2-methoxyphenyl)-
CAS No: 1020718-50-6 Catalog No: AG0006J5 MDL No:
Product Description
Catalog Number:
AG0006J5
Chemical Name:
2-Pyrrolidinone, 4-(2-methoxyphenyl)-
CAS Number:
1020718-50-6
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
IUPAC Name:
4-(2-methoxyphenyl)pyrrolidin-2-one
InChI:
InChI=1S/C11H13NO2/c1-14-10-5-3-2-4-9(10)8-6-11(13)12-7-8/h2-5,8H,6-7H2,1H3,(H,12,13)
InChI Key:
ZJWRMPWIYONZSB-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1CNC(=O)C1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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